USER MOD reduce.3.24.130724 H: found=0, std=0, add=1284, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1284 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 129 SER OG : rot 180:sc= 0.384 USER MOD Set 1.2: A 154 GLN : amide:sc= -0.114 X(o=0.27,f=-0.15) USER MOD Set 2.1: A 74 ASN : amide:sc= -1.62 K(o=-2,f=0.51) USER MOD Set 2.2: A 106 THR OG1 : rot 180:sc= -0.336 USER MOD Set 3.1: A 100 TYR OH : rot 180:sc= 0.565 USER MOD Set 3.2: A 112 TYR OH : rot -158:sc= -0.0836 USER MOD Set 3.3: A 138 ASN : amide:sc= 0.811 K(o=1.3,f=0.31) USER MOD Set 4.1: A 63 MET CE :methyl 177:sc= -2.88 (180deg=-2.93) USER MOD Set 4.2: A 82 CYS SG : rot 68:sc= 0.0108 USER MOD Single : A 1 MET CE :methyl 166:sc= -0.029 (180deg=-0.273) USER MOD Single : A 1 MET N :NH3+ -176:sc= 0 (180deg=-0.0132) USER MOD Single : A 3 HIS : no HD1:sc=-0.00194 X(o=-0.0019,f=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.475 K(o=-0.47,f=-2.4) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.101 K(o=-0.1,f=-0.69) USER MOD Single : A 8 HIS : no HD1:sc= -0.384 X(o=-0.38,f=-0.14) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HE2:sc= 0.328 K(o=0.33,f=-1.1) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot -170:sc= -0.163 USER MOD Single : A 16 ASN : amide:sc= -1.83! K(o=-1.8!,f=-0.4) USER MOD Single : A 19 GLN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : A 20 MET CE :methyl -120:sc= -0.834 (180deg=-3.74!) USER MOD Single : A 24 HIS : no HD1:sc= -0.287 X(o=-0.29,f=-0.28) USER MOD Single : A 25 MET CE :methyl 154:sc= -0.263 (180deg=-2.01) USER MOD Single : A 26 GLN : amide:sc= -0.0257 X(o=-0.026,f=-0.092) USER MOD Single : A 27 SER OG : rot -43:sc= 0.607 USER MOD Single : A 28 TYR OH : rot -104:sc= 0.514 USER MOD Single : A 29 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0979) USER MOD Single : A 31 ASN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.207 X(o=0.21,f=0) USER MOD Single : A 47 ASN : amide:sc= 0.413 X(o=0.41,f=-0.087) USER MOD Single : A 51 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 52 LYS NZ :NH3+ 166:sc= 1.48 (180deg=1.33) USER MOD Single : A 54 TYR OH : rot -150:sc= 0.00893 USER MOD Single : A 57 THR OG1 : rot 75:sc= 1.03 USER MOD Single : A 61 HIS : no HD1:sc= -0.557 X(o=-0.56,f=-0.27) USER MOD Single : A 64 LYS NZ :NH3+ 176:sc= 0.0928 (180deg=0.0561) USER MOD Single : A 69 LYS NZ :NH3+ -149:sc= 0.514 (180deg=0.204) USER MOD Single : A 70 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0185) USER MOD Single : A 71 LYS NZ :NH3+ -146:sc= -0.962 (180deg=-2.95!) USER MOD Single : A 72 TYR OH : rot -145:sc= -0.256 USER MOD Single : A 73 HIS : no HD1:sc= -0.736 K(o=-0.74,f=-0.041) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 130:sc= -0.184 USER MOD Single : A 84 LYS NZ :NH3+ 143:sc= 1.04 (180deg=0.244) USER MOD Single : A 88 TYR OH : rot 130:sc=-0.00579 USER MOD Single : A 89 ASN : amide:sc= 0.349 X(o=0.35,f=-0.044) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HE2:sc= -1.28 K(o=-1.3,f=-2) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 101 ASN : amide:sc= -1.71! X(o=-1.7!,f=-1.2) USER MOD Single : A 102 HIS : no HE2:sc= -2.56 K(o=-2.6,f=-3.5!) USER MOD Single : A 108 SER OG : rot -150:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -1.16 USER MOD Single : A 118 HIS : no HD1:sc= -1.72 X(o=-1.7,f=-1.6) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.083) USER MOD Single : A 126 GLN : amide:sc= -0.412 X(o=-0.41,f=-0.28) USER MOD Single : A 127 HIS : no HE2:sc= -0.572 K(o=-0.57,f=-3.2!) USER MOD Single : A 133 GLN : amide:sc= -0.524 K(o=-0.52,f=-1.2) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.14) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 GLN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 149 GLN : amide:sc= -0.577 X(o=-0.58,f=-0.11) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot -64:sc= 0.0719 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot -44:sc= 1.08 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 30.053 38.686 -4.412 1.00 52.53 N ATOM 2 CA MET A 1 30.747 37.421 -4.763 1.00 11.42 C ATOM 3 C MET A 1 29.819 36.458 -5.540 1.00 20.04 C ATOM 4 O MET A 1 30.257 35.806 -6.495 1.00 62.13 O ATOM 5 CB MET A 1 31.316 36.735 -3.483 1.00 54.43 C ATOM 6 CG MET A 1 30.273 36.265 -2.449 1.00 15.23 C ATOM 7 SD MET A 1 31.007 35.453 -1.008 1.00 43.15 S ATOM 8 CE MET A 1 31.936 36.790 -0.257 1.00 14.51 C ATOM 0 H1 MET A 1 30.724 39.334 -3.952 1.00 52.53 H new ATOM 0 H2 MET A 1 29.681 39.129 -5.276 1.00 52.53 H new ATOM 0 H3 MET A 1 29.268 38.482 -3.761 1.00 52.53 H new ATOM 0 HA MET A 1 31.580 37.671 -5.420 1.00 11.42 H new ATOM 0 HB2 MET A 1 31.909 35.873 -3.789 1.00 54.43 H new ATOM 0 HB3 MET A 1 31.996 37.432 -2.993 1.00 54.43 H new ATOM 0 HG2 MET A 1 29.690 37.124 -2.116 1.00 15.23 H new ATOM 0 HG3 MET A 1 29.579 35.576 -2.931 1.00 15.23 H new ATOM 0 HE1 MET A 1 32.229 36.507 0.754 1.00 14.51 H new ATOM 0 HE2 MET A 1 32.828 36.991 -0.850 1.00 14.51 H new ATOM 0 HE3 MET A 1 31.317 37.686 -0.218 1.00 14.51 H new ATOM 20 N GLY A 2 28.540 36.373 -5.122 1.00 20.01 N ATOM 21 CA GLY A 2 27.570 35.469 -5.751 1.00 54.11 C ATOM 22 C GLY A 2 26.424 35.087 -4.808 1.00 40.52 C ATOM 23 O GLY A 2 26.653 34.444 -3.783 1.00 33.24 O ATOM 0 H GLY A 2 28.160 36.922 -4.351 1.00 20.01 H new ATOM 0 HA2 GLY A 2 27.160 35.945 -6.642 1.00 54.11 H new ATOM 0 HA3 GLY A 2 28.082 34.565 -6.080 1.00 54.11 H new ATOM 27 N HIS A 3 25.201 35.513 -5.152 1.00 50.40 N ATOM 28 CA HIS A 3 23.960 35.139 -4.439 1.00 54.02 C ATOM 29 C HIS A 3 22.758 35.173 -5.414 1.00 51.32 C ATOM 30 O HIS A 3 22.771 35.915 -6.403 1.00 41.04 O ATOM 31 CB HIS A 3 23.718 36.051 -3.197 1.00 14.11 C ATOM 32 CG HIS A 3 23.720 37.543 -3.452 1.00 62.32 C ATOM 33 ND1 HIS A 3 24.622 38.402 -2.866 1.00 41.53 N ATOM 34 CD2 HIS A 3 22.905 38.332 -4.194 1.00 11.21 C ATOM 35 CE1 HIS A 3 24.364 39.636 -3.236 1.00 15.24 C ATOM 36 NE2 HIS A 3 23.334 39.618 -4.040 1.00 15.14 N ATOM 0 H HIS A 3 25.038 36.136 -5.943 1.00 50.40 H new ATOM 0 HA HIS A 3 24.070 34.121 -4.065 1.00 54.02 H new ATOM 0 HB2 HIS A 3 22.759 35.780 -2.755 1.00 14.11 H new ATOM 0 HB3 HIS A 3 24.485 35.829 -2.455 1.00 14.11 H new ATOM 0 HD2 HIS A 3 22.070 38.003 -4.796 1.00 11.21 H new ATOM 0 HE1 HIS A 3 24.910 40.515 -2.928 1.00 15.24 H new ATOM 0 HE2 HIS A 3 22.916 40.437 -4.483 1.00 15.14 H new ATOM 45 N HIS A 4 21.723 34.376 -5.118 1.00 61.12 N ATOM 46 CA HIS A 4 20.553 34.221 -6.010 1.00 52.31 C ATOM 47 C HIS A 4 19.636 35.476 -6.011 1.00 25.25 C ATOM 48 O HIS A 4 19.407 36.061 -7.075 1.00 30.55 O ATOM 49 CB HIS A 4 19.767 32.924 -5.656 1.00 34.14 C ATOM 50 CG HIS A 4 19.381 32.773 -4.204 1.00 2.31 C ATOM 51 ND1 HIS A 4 18.279 33.395 -3.651 1.00 14.24 N ATOM 52 CD2 HIS A 4 19.944 32.065 -3.194 1.00 21.22 C ATOM 53 CE1 HIS A 4 18.186 33.078 -2.381 1.00 53.41 C ATOM 54 NE2 HIS A 4 19.183 32.279 -2.079 1.00 72.11 N ATOM 0 H HIS A 4 21.667 33.823 -4.263 1.00 61.12 H new ATOM 0 HA HIS A 4 20.926 34.123 -7.029 1.00 52.31 H new ATOM 0 HB2 HIS A 4 18.860 32.894 -6.260 1.00 34.14 H new ATOM 0 HB3 HIS A 4 20.371 32.064 -5.945 1.00 34.14 H new ATOM 0 HD2 HIS A 4 20.828 31.448 -3.258 1.00 21.22 H new ATOM 0 HE1 HIS A 4 17.419 33.417 -1.700 1.00 53.41 H new ATOM 0 HE2 HIS A 4 19.362 31.881 -1.157 1.00 72.11 H new ATOM 63 N HIS A 5 19.159 35.877 -4.805 1.00 41.20 N ATOM 64 CA HIS A 5 18.242 37.032 -4.581 1.00 13.32 C ATOM 65 C HIS A 5 16.890 36.921 -5.357 1.00 62.43 C ATOM 66 O HIS A 5 15.841 36.707 -4.744 1.00 61.30 O ATOM 67 CB HIS A 5 18.960 38.378 -4.877 1.00 53.14 C ATOM 68 CG HIS A 5 18.101 39.601 -4.642 1.00 45.51 C ATOM 69 ND1 HIS A 5 17.562 40.354 -5.666 1.00 74.50 N ATOM 70 CD2 HIS A 5 17.695 40.203 -3.494 1.00 23.43 C ATOM 71 CE1 HIS A 5 16.868 41.352 -5.161 1.00 14.32 C ATOM 72 NE2 HIS A 5 16.931 41.282 -3.852 1.00 44.05 N ATOM 0 H HIS A 5 19.405 35.397 -3.939 1.00 41.20 H new ATOM 0 HA HIS A 5 17.975 37.006 -3.525 1.00 13.32 H new ATOM 0 HB2 HIS A 5 19.851 38.447 -4.252 1.00 53.14 H new ATOM 0 HB3 HIS A 5 19.297 38.378 -5.914 1.00 53.14 H new ATOM 0 HD2 HIS A 5 17.930 39.890 -2.488 1.00 23.43 H new ATOM 0 HE1 HIS A 5 16.336 42.102 -5.728 1.00 14.32 H new ATOM 0 HE2 HIS A 5 16.482 41.929 -3.204 1.00 44.05 H new ATOM 81 N HIS A 6 16.929 37.108 -6.692 1.00 41.53 N ATOM 82 CA HIS A 6 15.739 37.042 -7.571 1.00 51.41 C ATOM 83 C HIS A 6 15.044 35.654 -7.523 1.00 33.41 C ATOM 84 O HIS A 6 15.502 34.690 -8.151 1.00 1.23 O ATOM 85 CB HIS A 6 16.152 37.396 -9.022 1.00 41.12 C ATOM 86 CG HIS A 6 15.021 37.469 -10.027 1.00 74.20 C ATOM 87 ND1 HIS A 6 14.211 38.576 -10.168 1.00 31.15 N ATOM 88 CD2 HIS A 6 14.566 36.567 -10.937 1.00 73.23 C ATOM 89 CE1 HIS A 6 13.330 38.361 -11.117 1.00 64.33 C ATOM 90 NE2 HIS A 6 13.519 37.151 -11.596 1.00 44.34 N ATOM 0 H HIS A 6 17.792 37.311 -7.196 1.00 41.53 H new ATOM 0 HA HIS A 6 15.012 37.767 -7.207 1.00 51.41 H new ATOM 0 HB2 HIS A 6 16.665 38.357 -9.010 1.00 41.12 H new ATOM 0 HB3 HIS A 6 16.872 36.654 -9.367 1.00 41.12 H new ATOM 0 HD2 HIS A 6 14.958 35.575 -11.108 1.00 73.23 H new ATOM 0 HE1 HIS A 6 12.577 39.060 -11.449 1.00 64.33 H new ATOM 0 HE2 HIS A 6 12.972 36.717 -12.340 1.00 44.34 H new ATOM 99 N HIS A 7 13.938 35.572 -6.760 1.00 32.15 N ATOM 100 CA HIS A 7 13.123 34.349 -6.653 1.00 34.44 C ATOM 101 C HIS A 7 12.238 34.169 -7.907 1.00 0.44 C ATOM 102 O HIS A 7 11.103 34.654 -7.956 1.00 71.13 O ATOM 103 CB HIS A 7 12.264 34.373 -5.363 1.00 72.34 C ATOM 104 CG HIS A 7 13.063 34.315 -4.082 1.00 31.33 C ATOM 105 ND1 HIS A 7 13.622 35.426 -3.493 1.00 22.02 N ATOM 106 CD2 HIS A 7 13.390 33.272 -3.271 1.00 74.23 C ATOM 107 CE1 HIS A 7 14.245 35.079 -2.389 1.00 4.24 C ATOM 108 NE2 HIS A 7 14.120 33.782 -2.232 1.00 44.14 N ATOM 0 H HIS A 7 13.586 36.350 -6.202 1.00 32.15 H new ATOM 0 HA HIS A 7 13.796 33.494 -6.592 1.00 34.44 H new ATOM 0 HB2 HIS A 7 11.660 35.280 -5.360 1.00 72.34 H new ATOM 0 HB3 HIS A 7 11.573 33.530 -5.385 1.00 72.34 H new ATOM 0 HD2 HIS A 7 13.123 32.236 -3.420 1.00 74.23 H new ATOM 0 HE1 HIS A 7 14.771 35.748 -1.724 1.00 4.24 H new ATOM 0 HE2 HIS A 7 14.506 33.240 -1.459 1.00 44.14 H new ATOM 117 N HIS A 8 12.798 33.519 -8.942 1.00 4.35 N ATOM 118 CA HIS A 8 12.038 33.151 -10.154 1.00 1.31 C ATOM 119 C HIS A 8 11.026 32.015 -9.842 1.00 12.53 C ATOM 120 O HIS A 8 11.393 31.013 -9.218 1.00 54.23 O ATOM 121 CB HIS A 8 13.007 32.771 -11.318 1.00 23.35 C ATOM 122 CG HIS A 8 14.089 31.763 -10.970 1.00 34.33 C ATOM 123 ND1 HIS A 8 15.413 32.108 -10.789 1.00 64.40 N ATOM 124 CD2 HIS A 8 14.045 30.416 -10.818 1.00 13.03 C ATOM 125 CE1 HIS A 8 16.120 31.026 -10.542 1.00 32.24 C ATOM 126 NE2 HIS A 8 15.317 29.993 -10.557 1.00 51.22 N ATOM 0 H HIS A 8 13.778 33.236 -8.965 1.00 4.35 H new ATOM 0 HA HIS A 8 11.462 34.016 -10.483 1.00 1.31 H new ATOM 0 HB2 HIS A 8 12.416 32.373 -12.143 1.00 23.35 H new ATOM 0 HB3 HIS A 8 13.486 33.681 -11.679 1.00 23.35 H new ATOM 0 HD2 HIS A 8 13.166 29.793 -10.890 1.00 13.03 H new ATOM 0 HE1 HIS A 8 17.184 30.996 -10.358 1.00 32.24 H new ATOM 0 HE2 HIS A 8 15.597 29.025 -10.399 1.00 51.22 H new ATOM 135 N SER A 9 9.751 32.202 -10.246 1.00 34.52 N ATOM 136 CA SER A 9 8.676 31.204 -10.014 1.00 62.32 C ATOM 137 C SER A 9 8.918 29.924 -10.854 1.00 50.22 C ATOM 138 O SER A 9 8.458 29.805 -11.995 1.00 61.43 O ATOM 139 CB SER A 9 7.278 31.806 -10.319 1.00 35.04 C ATOM 140 OG SER A 9 6.996 32.913 -9.470 1.00 11.55 O ATOM 0 H SER A 9 9.437 33.039 -10.737 1.00 34.52 H new ATOM 0 HA SER A 9 8.700 30.928 -8.960 1.00 62.32 H new ATOM 0 HB2 SER A 9 7.236 32.124 -11.361 1.00 35.04 H new ATOM 0 HB3 SER A 9 6.513 31.040 -10.188 1.00 35.04 H new ATOM 0 HG SER A 9 6.110 33.273 -9.685 1.00 11.55 H new ATOM 146 N HIS A 10 9.697 28.992 -10.281 1.00 61.12 N ATOM 147 CA HIS A 10 10.083 27.730 -10.939 1.00 54.24 C ATOM 148 C HIS A 10 9.685 26.529 -10.061 1.00 41.43 C ATOM 149 O HIS A 10 10.140 26.407 -8.921 1.00 20.33 O ATOM 150 CB HIS A 10 11.608 27.712 -11.214 1.00 63.54 C ATOM 151 CG HIS A 10 12.104 26.468 -11.905 1.00 1.44 C ATOM 152 ND1 HIS A 10 12.622 25.384 -11.226 1.00 71.43 N ATOM 153 CD2 HIS A 10 12.159 26.139 -13.218 1.00 34.21 C ATOM 154 CE1 HIS A 10 12.967 24.450 -12.086 1.00 1.14 C ATOM 155 NE2 HIS A 10 12.698 24.885 -13.295 1.00 42.20 N ATOM 0 H HIS A 10 10.080 29.093 -9.341 1.00 61.12 H new ATOM 0 HA HIS A 10 9.557 27.657 -11.891 1.00 54.24 H new ATOM 0 HB2 HIS A 10 11.865 28.578 -11.824 1.00 63.54 H new ATOM 0 HB3 HIS A 10 12.136 27.821 -10.267 1.00 63.54 H new ATOM 0 HD1 HIS A 10 12.722 25.317 -10.213 1.00 71.43 H new ATOM 0 HD2 HIS A 10 11.838 26.752 -14.047 1.00 34.21 H new ATOM 0 HE1 HIS A 10 13.397 23.491 -11.840 1.00 1.14 H new ATOM 164 N MET A 11 8.838 25.653 -10.610 1.00 54.43 N ATOM 165 CA MET A 11 8.443 24.391 -9.968 1.00 72.12 C ATOM 166 C MET A 11 9.596 23.375 -10.113 1.00 51.11 C ATOM 167 O MET A 11 9.786 22.775 -11.174 1.00 1.21 O ATOM 168 CB MET A 11 7.128 23.872 -10.600 1.00 61.54 C ATOM 169 CG MET A 11 5.932 24.826 -10.410 1.00 32.44 C ATOM 170 SD MET A 11 6.198 26.465 -11.138 1.00 72.12 S ATOM 171 CE MET A 11 4.695 27.334 -10.687 1.00 41.24 C ATOM 0 H MET A 11 8.402 25.799 -11.521 1.00 54.43 H new ATOM 0 HA MET A 11 8.255 24.544 -8.905 1.00 72.12 H new ATOM 0 HB2 MET A 11 7.287 23.710 -11.666 1.00 61.54 H new ATOM 0 HB3 MET A 11 6.882 22.904 -10.163 1.00 61.54 H new ATOM 0 HG2 MET A 11 5.044 24.378 -10.856 1.00 32.44 H new ATOM 0 HG3 MET A 11 5.731 24.938 -9.345 1.00 32.44 H new ATOM 0 HE1 MET A 11 4.733 28.352 -11.074 1.00 41.24 H new ATOM 0 HE2 MET A 11 3.834 26.816 -11.111 1.00 41.24 H new ATOM 0 HE3 MET A 11 4.603 27.362 -9.601 1.00 41.24 H new ATOM 181 N ASP A 12 10.398 23.249 -9.048 1.00 51.24 N ATOM 182 CA ASP A 12 11.618 22.411 -9.032 1.00 22.34 C ATOM 183 C ASP A 12 11.261 20.916 -9.067 1.00 31.43 C ATOM 184 O ASP A 12 10.214 20.529 -8.551 1.00 62.40 O ATOM 185 CB ASP A 12 12.443 22.725 -7.765 1.00 40.32 C ATOM 186 CG ASP A 12 12.687 24.229 -7.607 1.00 50.34 C ATOM 187 OD1 ASP A 12 13.508 24.784 -8.358 1.00 13.25 O ATOM 188 OD2 ASP A 12 12.035 24.865 -6.747 1.00 70.02 O ATOM 0 H ASP A 12 10.223 23.726 -8.164 1.00 51.24 H new ATOM 0 HA ASP A 12 12.207 22.640 -9.920 1.00 22.34 H new ATOM 0 HB2 ASP A 12 11.920 22.347 -6.887 1.00 40.32 H new ATOM 0 HB3 ASP A 12 13.399 22.204 -7.815 1.00 40.32 H new ATOM 193 N THR A 13 12.138 20.095 -9.672 1.00 24.23 N ATOM 194 CA THR A 13 11.940 18.625 -9.754 1.00 21.03 C ATOM 195 C THR A 13 11.720 17.985 -8.346 1.00 75.11 C ATOM 196 O THR A 13 12.352 18.412 -7.362 1.00 35.33 O ATOM 197 CB THR A 13 13.141 17.911 -10.481 1.00 22.34 C ATOM 198 OG1 THR A 13 12.907 16.495 -10.572 1.00 14.34 O ATOM 199 CG2 THR A 13 14.482 18.152 -9.769 1.00 1.12 C ATOM 0 H THR A 13 12.997 20.421 -10.115 1.00 24.23 H new ATOM 0 HA THR A 13 11.037 18.474 -10.346 1.00 21.03 H new ATOM 0 HB THR A 13 13.202 18.345 -11.479 1.00 22.34 H new ATOM 0 HG1 THR A 13 13.723 16.048 -10.880 1.00 14.34 H new ATOM 0 HG21 THR A 13 15.278 17.639 -10.309 1.00 1.12 H new ATOM 0 HG22 THR A 13 14.692 19.221 -9.742 1.00 1.12 H new ATOM 0 HG23 THR A 13 14.428 17.767 -8.751 1.00 1.12 H new ATOM 207 N PRO A 14 10.805 16.962 -8.221 1.00 15.13 N ATOM 208 CA PRO A 14 10.536 16.278 -6.926 1.00 23.23 C ATOM 209 C PRO A 14 11.770 15.549 -6.354 1.00 71.42 C ATOM 210 O PRO A 14 11.748 15.136 -5.192 1.00 24.23 O ATOM 211 CB PRO A 14 9.401 15.285 -7.271 1.00 12.34 C ATOM 212 CG PRO A 14 9.521 15.071 -8.751 1.00 10.15 C ATOM 213 CD PRO A 14 9.947 16.408 -9.305 1.00 73.02 C ATOM 0 HA PRO A 14 10.269 16.988 -6.143 1.00 23.23 H new ATOM 0 HB2 PRO A 14 9.514 14.349 -6.725 1.00 12.34 H new ATOM 0 HB3 PRO A 14 8.425 15.692 -7.007 1.00 12.34 H new ATOM 0 HG2 PRO A 14 10.254 14.297 -8.980 1.00 10.15 H new ATOM 0 HG3 PRO A 14 8.573 14.749 -9.182 1.00 10.15 H new ATOM 0 HD2 PRO A 14 10.497 16.301 -10.240 1.00 73.02 H new ATOM 0 HD3 PRO A 14 9.091 17.051 -9.511 1.00 73.02 H new ATOM 221 N GLU A 15 12.828 15.392 -7.187 1.00 22.34 N ATOM 222 CA GLU A 15 14.144 14.899 -6.740 1.00 24.42 C ATOM 223 C GLU A 15 14.728 15.798 -5.623 1.00 43.11 C ATOM 224 O GLU A 15 15.137 15.296 -4.586 1.00 61.11 O ATOM 225 CB GLU A 15 15.141 14.831 -7.929 1.00 52.34 C ATOM 226 CG GLU A 15 14.674 13.957 -9.106 1.00 3.15 C ATOM 227 CD GLU A 15 15.708 13.895 -10.244 1.00 21.24 C ATOM 228 OE1 GLU A 15 15.762 14.842 -11.057 1.00 75.15 O ATOM 229 OE2 GLU A 15 16.490 12.916 -10.309 1.00 4.40 O ATOM 0 H GLU A 15 12.788 15.604 -8.184 1.00 22.34 H new ATOM 0 HA GLU A 15 13.998 13.896 -6.340 1.00 24.42 H new ATOM 0 HB2 GLU A 15 15.321 15.842 -8.293 1.00 52.34 H new ATOM 0 HB3 GLU A 15 16.095 14.449 -7.565 1.00 52.34 H new ATOM 0 HG2 GLU A 15 14.473 12.948 -8.747 1.00 3.15 H new ATOM 0 HG3 GLU A 15 13.734 14.350 -9.495 1.00 3.15 H new ATOM 236 N ASN A 16 14.726 17.128 -5.860 1.00 70.40 N ATOM 237 CA ASN A 16 15.219 18.139 -4.887 1.00 63.14 C ATOM 238 C ASN A 16 14.400 18.097 -3.573 1.00 23.52 C ATOM 239 O ASN A 16 14.965 18.036 -2.475 1.00 62.01 O ATOM 240 CB ASN A 16 15.146 19.559 -5.507 1.00 63.12 C ATOM 241 CG ASN A 16 15.909 19.694 -6.823 1.00 44.14 C ATOM 242 OD1 ASN A 16 16.865 18.977 -7.083 1.00 33.55 O ATOM 243 ND2 ASN A 16 15.500 20.628 -7.657 1.00 42.04 N ATOM 0 H ASN A 16 14.383 17.535 -6.730 1.00 70.40 H new ATOM 0 HA ASN A 16 16.256 17.901 -4.652 1.00 63.14 H new ATOM 0 HB2 ASN A 16 14.101 19.819 -5.675 1.00 63.12 H new ATOM 0 HB3 ASN A 16 15.543 20.279 -4.792 1.00 63.12 H new ATOM 0 HD21 ASN A 16 15.984 20.767 -8.544 1.00 42.04 H new ATOM 0 HD22 ASN A 16 14.700 21.212 -7.416 1.00 42.04 H new ATOM 250 N VAL A 17 13.056 18.102 -3.734 1.00 24.52 N ATOM 251 CA VAL A 17 12.078 18.006 -2.617 1.00 34.33 C ATOM 252 C VAL A 17 12.343 16.759 -1.733 1.00 33.22 C ATOM 253 O VAL A 17 12.309 16.823 -0.501 1.00 30.43 O ATOM 254 CB VAL A 17 10.601 17.957 -3.183 1.00 73.41 C ATOM 255 CG1 VAL A 17 9.537 17.796 -2.065 1.00 75.23 C ATOM 256 CG2 VAL A 17 10.297 19.201 -4.061 1.00 63.10 C ATOM 0 H VAL A 17 12.613 18.173 -4.650 1.00 24.52 H new ATOM 0 HA VAL A 17 12.199 18.894 -1.996 1.00 34.33 H new ATOM 0 HB VAL A 17 10.538 17.067 -3.809 1.00 73.41 H new ATOM 0 HG11 VAL A 17 8.543 17.768 -2.510 1.00 75.23 H new ATOM 0 HG12 VAL A 17 9.717 16.868 -1.522 1.00 75.23 H new ATOM 0 HG13 VAL A 17 9.603 18.638 -1.376 1.00 75.23 H new ATOM 0 HG21 VAL A 17 9.275 19.141 -4.436 1.00 63.10 H new ATOM 0 HG22 VAL A 17 10.411 20.105 -3.463 1.00 63.10 H new ATOM 0 HG23 VAL A 17 10.991 19.232 -4.901 1.00 63.10 H new ATOM 266 N LEU A 18 12.651 15.649 -2.404 1.00 11.40 N ATOM 267 CA LEU A 18 12.941 14.352 -1.773 1.00 24.22 C ATOM 268 C LEU A 18 14.309 14.370 -1.042 1.00 51.11 C ATOM 269 O LEU A 18 14.416 13.913 0.094 1.00 25.02 O ATOM 270 CB LEU A 18 12.874 13.273 -2.880 1.00 21.50 C ATOM 271 CG LEU A 18 13.084 11.781 -2.477 1.00 71.23 C ATOM 272 CD1 LEU A 18 12.386 11.433 -1.146 1.00 54.42 C ATOM 273 CD2 LEU A 18 12.575 10.870 -3.606 1.00 23.24 C ATOM 0 H LEU A 18 12.708 15.621 -3.422 1.00 11.40 H new ATOM 0 HA LEU A 18 12.205 14.127 -1.001 1.00 24.22 H new ATOM 0 HB2 LEU A 18 11.900 13.352 -3.362 1.00 21.50 H new ATOM 0 HB3 LEU A 18 13.623 13.522 -3.632 1.00 21.50 H new ATOM 0 HG LEU A 18 14.151 11.620 -2.326 1.00 71.23 H new ATOM 0 HD11 LEU A 18 12.560 10.384 -0.907 1.00 54.42 H new ATOM 0 HD12 LEU A 18 12.789 12.058 -0.349 1.00 54.42 H new ATOM 0 HD13 LEU A 18 11.315 11.610 -1.240 1.00 54.42 H new ATOM 0 HD21 LEU A 18 12.721 9.827 -3.326 1.00 23.24 H new ATOM 0 HD22 LEU A 18 11.514 11.056 -3.773 1.00 23.24 H new ATOM 0 HD23 LEU A 18 13.128 11.081 -4.521 1.00 23.24 H new ATOM 285 N GLN A 19 15.322 14.960 -1.687 1.00 62.14 N ATOM 286 CA GLN A 19 16.678 15.112 -1.109 1.00 52.45 C ATOM 287 C GLN A 19 16.677 16.028 0.136 1.00 4.53 C ATOM 288 O GLN A 19 17.565 15.916 0.983 1.00 65.33 O ATOM 289 CB GLN A 19 17.654 15.664 -2.178 1.00 61.42 C ATOM 290 CG GLN A 19 17.936 14.703 -3.352 1.00 44.52 C ATOM 291 CD GLN A 19 18.715 15.335 -4.516 1.00 30.25 C ATOM 292 OE1 GLN A 19 18.537 14.958 -5.669 1.00 70.31 O ATOM 293 NE2 GLN A 19 19.592 16.288 -4.233 1.00 64.21 N ATOM 0 H GLN A 19 15.233 15.349 -2.626 1.00 62.14 H new ATOM 0 HA GLN A 19 17.011 14.125 -0.789 1.00 52.45 H new ATOM 0 HB2 GLN A 19 17.247 16.593 -2.577 1.00 61.42 H new ATOM 0 HB3 GLN A 19 18.599 15.912 -1.694 1.00 61.42 H new ATOM 0 HG2 GLN A 19 18.497 13.847 -2.978 1.00 44.52 H new ATOM 0 HG3 GLN A 19 16.987 14.322 -3.730 1.00 44.52 H new ATOM 0 HE21 GLN A 19 19.726 16.588 -3.267 1.00 64.21 H new ATOM 0 HE22 GLN A 19 20.133 16.722 -4.981 1.00 64.21 H new ATOM 302 N MET A 20 15.676 16.936 0.230 1.00 53.41 N ATOM 303 CA MET A 20 15.478 17.767 1.440 1.00 31.35 C ATOM 304 C MET A 20 15.197 16.885 2.687 1.00 62.30 C ATOM 305 O MET A 20 15.914 16.990 3.689 1.00 53.45 O ATOM 306 CB MET A 20 14.339 18.811 1.253 1.00 25.13 C ATOM 307 CG MET A 20 14.597 19.865 0.166 1.00 12.21 C ATOM 308 SD MET A 20 13.514 21.314 0.310 1.00 31.43 S ATOM 309 CE MET A 20 11.875 20.620 0.093 1.00 15.01 C ATOM 0 H MET A 20 14.998 17.110 -0.512 1.00 53.41 H new ATOM 0 HA MET A 20 16.407 18.314 1.600 1.00 31.35 H new ATOM 0 HB2 MET A 20 13.417 18.281 1.013 1.00 25.13 H new ATOM 0 HB3 MET A 20 14.175 19.322 2.202 1.00 25.13 H new ATOM 0 HG2 MET A 20 15.636 20.189 0.221 1.00 12.21 H new ATOM 0 HG3 MET A 20 14.457 19.410 -0.814 1.00 12.21 H new ATOM 0 HE1 MET A 20 11.397 21.079 -0.773 1.00 15.01 H new ATOM 0 HE2 MET A 20 11.953 19.544 -0.064 1.00 15.01 H new ATOM 0 HE3 MET A 20 11.277 20.815 0.983 1.00 15.01 H new ATOM 319 N LEU A 21 14.174 15.998 2.607 1.00 52.32 N ATOM 320 CA LEU A 21 13.827 15.102 3.741 1.00 12.44 C ATOM 321 C LEU A 21 14.949 14.077 4.015 1.00 63.22 C ATOM 322 O LEU A 21 15.194 13.726 5.167 1.00 71.32 O ATOM 323 CB LEU A 21 12.428 14.408 3.554 1.00 31.55 C ATOM 324 CG LEU A 21 12.201 13.456 2.321 1.00 25.23 C ATOM 325 CD1 LEU A 21 12.852 12.065 2.503 1.00 50.02 C ATOM 326 CD2 LEU A 21 10.701 13.306 1.994 1.00 41.54 C ATOM 0 H LEU A 21 13.583 15.884 1.784 1.00 52.32 H new ATOM 0 HA LEU A 21 13.738 15.733 4.626 1.00 12.44 H new ATOM 0 HB2 LEU A 21 12.225 13.830 4.456 1.00 31.55 H new ATOM 0 HB3 LEU A 21 11.676 15.195 3.504 1.00 31.55 H new ATOM 0 HG LEU A 21 12.699 13.935 1.478 1.00 25.23 H new ATOM 0 HD11 LEU A 21 12.660 11.455 1.620 1.00 50.02 H new ATOM 0 HD12 LEU A 21 13.927 12.181 2.637 1.00 50.02 H new ATOM 0 HD13 LEU A 21 12.428 11.577 3.380 1.00 50.02 H new ATOM 0 HD21 LEU A 21 10.580 12.642 1.138 1.00 41.54 H new ATOM 0 HD22 LEU A 21 10.181 12.886 2.855 1.00 41.54 H new ATOM 0 HD23 LEU A 21 10.281 14.284 1.758 1.00 41.54 H new ATOM 338 N GLU A 22 15.622 13.610 2.935 1.00 60.11 N ATOM 339 CA GLU A 22 16.762 12.669 3.036 1.00 11.40 C ATOM 340 C GLU A 22 17.911 13.289 3.853 1.00 2.54 C ATOM 341 O GLU A 22 18.468 12.635 4.728 1.00 53.24 O ATOM 342 CB GLU A 22 17.270 12.241 1.632 1.00 5.15 C ATOM 343 CG GLU A 22 16.268 11.409 0.807 1.00 40.31 C ATOM 344 CD GLU A 22 16.847 10.938 -0.536 1.00 52.24 C ATOM 345 OE1 GLU A 22 17.482 9.861 -0.572 1.00 32.33 O ATOM 346 OE2 GLU A 22 16.698 11.651 -1.551 1.00 23.34 O ATOM 0 H GLU A 22 15.391 13.873 1.977 1.00 60.11 H new ATOM 0 HA GLU A 22 16.407 11.777 3.553 1.00 11.40 H new ATOM 0 HB2 GLU A 22 17.529 13.136 1.067 1.00 5.15 H new ATOM 0 HB3 GLU A 22 18.187 11.664 1.753 1.00 5.15 H new ATOM 0 HG2 GLU A 22 15.959 10.540 1.388 1.00 40.31 H new ATOM 0 HG3 GLU A 22 15.374 12.004 0.623 1.00 40.31 H new ATOM 353 N ALA A 23 18.210 14.575 3.579 1.00 64.31 N ATOM 354 CA ALA A 23 19.241 15.350 4.304 1.00 23.34 C ATOM 355 C ALA A 23 18.922 15.478 5.816 1.00 14.44 C ATOM 356 O ALA A 23 19.822 15.694 6.625 1.00 3.05 O ATOM 357 CB ALA A 23 19.394 16.735 3.659 1.00 41.43 C ATOM 0 H ALA A 23 17.742 15.108 2.846 1.00 64.31 H new ATOM 0 HA ALA A 23 20.184 14.809 4.228 1.00 23.34 H new ATOM 0 HB1 ALA A 23 20.154 17.304 4.195 1.00 41.43 H new ATOM 0 HB2 ALA A 23 19.694 16.620 2.617 1.00 41.43 H new ATOM 0 HB3 ALA A 23 18.443 17.266 3.706 1.00 41.43 H new ATOM 363 N HIS A 24 17.630 15.362 6.172 1.00 70.32 N ATOM 364 CA HIS A 24 17.175 15.289 7.576 1.00 54.21 C ATOM 365 C HIS A 24 17.304 13.840 8.131 1.00 44.10 C ATOM 366 O HIS A 24 17.658 13.650 9.300 1.00 15.14 O ATOM 367 CB HIS A 24 15.704 15.781 7.661 1.00 73.02 C ATOM 368 CG HIS A 24 15.092 15.741 9.042 1.00 41.22 C ATOM 369 ND1 HIS A 24 15.273 16.736 9.970 1.00 31.41 N ATOM 370 CD2 HIS A 24 14.289 14.826 9.642 1.00 2.45 C ATOM 371 CE1 HIS A 24 14.614 16.442 11.068 1.00 32.44 C ATOM 372 NE2 HIS A 24 14.003 15.291 10.900 1.00 31.03 N ATOM 0 H HIS A 24 16.869 15.316 5.494 1.00 70.32 H new ATOM 0 HA HIS A 24 17.808 15.931 8.189 1.00 54.21 H new ATOM 0 HB2 HIS A 24 15.658 16.805 7.290 1.00 73.02 H new ATOM 0 HB3 HIS A 24 15.095 15.172 6.993 1.00 73.02 H new ATOM 0 HD2 HIS A 24 13.939 13.901 9.208 1.00 2.45 H new ATOM 0 HE1 HIS A 24 14.580 17.047 11.962 1.00 32.44 H new ATOM 0 HE2 HIS A 24 13.415 14.822 11.589 1.00 31.03 H new ATOM 381 N MET A 25 17.016 12.838 7.271 1.00 43.21 N ATOM 382 CA MET A 25 16.983 11.401 7.657 1.00 20.11 C ATOM 383 C MET A 25 18.378 10.829 8.000 1.00 21.21 C ATOM 384 O MET A 25 18.475 9.962 8.874 1.00 53.22 O ATOM 385 CB MET A 25 16.332 10.541 6.537 1.00 12.54 C ATOM 386 CG MET A 25 14.845 10.812 6.339 1.00 54.24 C ATOM 387 SD MET A 25 13.910 10.544 7.855 1.00 70.34 S ATOM 388 CE MET A 25 12.308 11.174 7.378 1.00 75.51 C ATOM 0 H MET A 25 16.799 12.998 6.287 1.00 43.21 H new ATOM 0 HA MET A 25 16.379 11.350 8.563 1.00 20.11 H new ATOM 0 HB2 MET A 25 16.854 10.728 5.599 1.00 12.54 H new ATOM 0 HB3 MET A 25 16.471 9.486 6.774 1.00 12.54 H new ATOM 0 HG2 MET A 25 14.704 11.839 6.002 1.00 54.24 H new ATOM 0 HG3 MET A 25 14.458 10.163 5.554 1.00 54.24 H new ATOM 0 HE1 MET A 25 11.534 10.690 7.974 1.00 75.51 H new ATOM 0 HE2 MET A 25 12.276 12.250 7.546 1.00 75.51 H new ATOM 0 HE3 MET A 25 12.135 10.966 6.322 1.00 75.51 H new ATOM 398 N GLN A 26 19.429 11.304 7.289 1.00 44.22 N ATOM 399 CA GLN A 26 20.835 10.805 7.432 1.00 60.14 C ATOM 400 C GLN A 26 21.327 10.658 8.909 1.00 4.50 C ATOM 401 O GLN A 26 22.130 9.771 9.211 1.00 75.23 O ATOM 402 CB GLN A 26 21.828 11.718 6.656 1.00 21.32 C ATOM 403 CG GLN A 26 21.479 11.994 5.174 1.00 25.20 C ATOM 404 CD GLN A 26 21.235 10.738 4.308 1.00 63.13 C ATOM 405 OE1 GLN A 26 21.808 9.675 4.529 1.00 33.34 O ATOM 406 NE2 GLN A 26 20.392 10.864 3.299 1.00 61.23 N ATOM 0 H GLN A 26 19.334 12.046 6.596 1.00 44.22 H new ATOM 0 HA GLN A 26 20.817 9.802 7.006 1.00 60.14 H new ATOM 0 HB2 GLN A 26 21.895 12.673 7.177 1.00 21.32 H new ATOM 0 HB3 GLN A 26 22.817 11.262 6.697 1.00 21.32 H new ATOM 0 HG2 GLN A 26 20.586 12.619 5.138 1.00 25.20 H new ATOM 0 HG3 GLN A 26 22.290 12.571 4.728 1.00 25.20 H new ATOM 0 HE21 GLN A 26 19.926 11.756 3.132 1.00 61.23 H new ATOM 0 HE22 GLN A 26 20.207 10.069 2.687 1.00 61.23 H new ATOM 415 N SER A 27 20.841 11.531 9.811 1.00 62.12 N ATOM 416 CA SER A 27 21.198 11.500 11.259 1.00 63.21 C ATOM 417 C SER A 27 19.930 11.535 12.155 1.00 20.31 C ATOM 418 O SER A 27 19.997 11.869 13.338 1.00 42.11 O ATOM 419 CB SER A 27 22.151 12.683 11.587 1.00 23.53 C ATOM 420 OG SER A 27 22.625 12.639 12.930 1.00 41.12 O ATOM 0 H SER A 27 20.191 12.279 9.567 1.00 62.12 H new ATOM 0 HA SER A 27 21.713 10.563 11.472 1.00 63.21 H new ATOM 0 HB2 SER A 27 23.000 12.663 10.904 1.00 23.53 H new ATOM 0 HB3 SER A 27 21.629 13.625 11.419 1.00 23.53 H new ATOM 0 HG SER A 27 21.885 12.411 13.531 1.00 41.12 H new ATOM 426 N TYR A 28 18.776 11.150 11.582 1.00 2.14 N ATOM 427 CA TYR A 28 17.471 11.108 12.300 1.00 43.02 C ATOM 428 C TYR A 28 17.250 9.730 12.981 1.00 75.00 C ATOM 429 O TYR A 28 16.539 9.639 13.992 1.00 11.52 O ATOM 430 CB TYR A 28 16.327 11.440 11.302 1.00 21.25 C ATOM 431 CG TYR A 28 14.938 11.703 11.914 1.00 73.11 C ATOM 432 CD1 TYR A 28 14.773 12.573 13.001 1.00 41.04 C ATOM 433 CD2 TYR A 28 13.786 11.110 11.382 1.00 51.40 C ATOM 434 CE1 TYR A 28 13.516 12.832 13.526 1.00 52.24 C ATOM 435 CE2 TYR A 28 12.539 11.373 11.913 1.00 2.53 C ATOM 436 CZ TYR A 28 12.406 12.226 12.974 1.00 0.21 C ATOM 437 OH TYR A 28 11.153 12.475 13.489 1.00 32.33 O ATOM 0 H TYR A 28 18.712 10.857 10.607 1.00 2.14 H new ATOM 0 HA TYR A 28 17.474 11.855 13.094 1.00 43.02 H new ATOM 0 HB2 TYR A 28 16.619 12.319 10.728 1.00 21.25 H new ATOM 0 HB3 TYR A 28 16.239 10.614 10.597 1.00 21.25 H new ATOM 0 HD1 TYR A 28 15.639 13.049 13.437 1.00 41.04 H new ATOM 0 HD2 TYR A 28 13.875 10.436 10.543 1.00 51.40 H new ATOM 0 HE1 TYR A 28 13.406 13.505 14.363 1.00 52.24 H new ATOM 0 HE2 TYR A 28 11.664 10.903 11.489 1.00 2.53 H new ATOM 0 HH TYR A 28 10.861 11.708 14.025 1.00 32.33 H new ATOM 447 N LYS A 29 17.900 8.677 12.414 1.00 33.22 N ATOM 448 CA LYS A 29 17.833 7.274 12.901 1.00 1.14 C ATOM 449 C LYS A 29 16.387 6.708 12.833 1.00 31.12 C ATOM 450 O LYS A 29 16.001 6.069 11.843 1.00 52.31 O ATOM 451 CB LYS A 29 18.450 7.131 14.333 1.00 30.13 C ATOM 452 CG LYS A 29 19.968 7.425 14.428 1.00 51.02 C ATOM 453 CD LYS A 29 20.840 6.334 13.757 1.00 10.03 C ATOM 454 CE LYS A 29 20.795 4.985 14.495 1.00 12.01 C ATOM 455 NZ LYS A 29 21.344 5.081 15.875 1.00 54.33 N ATOM 0 H LYS A 29 18.495 8.783 11.592 1.00 33.22 H new ATOM 0 HA LYS A 29 18.441 6.669 12.228 1.00 1.14 H new ATOM 0 HB2 LYS A 29 17.922 7.805 15.008 1.00 30.13 H new ATOM 0 HB3 LYS A 29 18.269 6.117 14.690 1.00 30.13 H new ATOM 0 HG2 LYS A 29 20.176 8.387 13.960 1.00 51.02 H new ATOM 0 HG3 LYS A 29 20.250 7.513 15.477 1.00 51.02 H new ATOM 0 HD2 LYS A 29 20.505 6.190 12.730 1.00 10.03 H new ATOM 0 HD3 LYS A 29 21.872 6.681 13.710 1.00 10.03 H new ATOM 0 HE2 LYS A 29 19.765 4.631 14.539 1.00 12.01 H new ATOM 0 HE3 LYS A 29 21.362 4.245 13.931 1.00 12.01 H new ATOM 0 HZ1 LYS A 29 21.452 4.126 16.273 1.00 54.33 H new ATOM 0 HZ2 LYS A 29 22.271 5.551 15.848 1.00 54.33 H new ATOM 0 HZ3 LYS A 29 20.693 5.633 16.470 1.00 54.33 H new ATOM 469 N GLY A 30 15.596 6.967 13.888 1.00 20.41 N ATOM 470 CA GLY A 30 14.196 6.534 13.967 1.00 64.23 C ATOM 471 C GLY A 30 13.273 7.704 14.283 1.00 23.41 C ATOM 472 O GLY A 30 13.021 8.535 13.403 1.00 22.54 O ATOM 0 H GLY A 30 15.912 7.483 14.709 1.00 20.41 H new ATOM 0 HA2 GLY A 30 13.900 6.079 13.022 1.00 64.23 H new ATOM 0 HA3 GLY A 30 14.093 5.768 14.736 1.00 64.23 H new ATOM 476 N ASN A 31 12.754 7.759 15.540 1.00 4.14 N ATOM 477 CA ASN A 31 11.901 8.871 16.042 1.00 61.54 C ATOM 478 C ASN A 31 10.618 9.058 15.185 1.00 24.00 C ATOM 479 O ASN A 31 10.097 10.177 15.071 1.00 0.03 O ATOM 480 CB ASN A 31 12.731 10.196 16.123 1.00 12.14 C ATOM 481 CG ASN A 31 13.790 10.219 17.234 1.00 12.02 C ATOM 482 OD1 ASN A 31 14.287 9.192 17.675 1.00 25.45 O ATOM 483 ND2 ASN A 31 14.150 11.402 17.692 1.00 13.45 N ATOM 0 H ASN A 31 12.916 7.031 16.235 1.00 4.14 H new ATOM 0 HA ASN A 31 11.568 8.607 17.046 1.00 61.54 H new ATOM 0 HB2 ASN A 31 13.225 10.359 15.165 1.00 12.14 H new ATOM 0 HB3 ASN A 31 12.046 11.030 16.275 1.00 12.14 H new ATOM 0 HD21 ASN A 31 14.854 11.472 18.427 1.00 13.45 H new ATOM 0 HD22 ASN A 31 13.724 12.247 17.312 1.00 13.45 H new ATOM 490 N ASP A 32 10.117 7.932 14.623 1.00 4.34 N ATOM 491 CA ASP A 32 8.999 7.903 13.650 1.00 65.21 C ATOM 492 C ASP A 32 9.340 8.757 12.391 1.00 2.21 C ATOM 493 O ASP A 32 8.936 9.922 12.297 1.00 41.33 O ATOM 494 CB ASP A 32 7.655 8.343 14.314 1.00 45.02 C ATOM 495 CG ASP A 32 6.415 8.127 13.423 1.00 45.24 C ATOM 496 OD1 ASP A 32 5.965 6.971 13.298 1.00 53.33 O ATOM 497 OD2 ASP A 32 5.883 9.111 12.852 1.00 62.22 O ATOM 0 H ASP A 32 10.484 7.004 14.836 1.00 4.34 H new ATOM 0 HA ASP A 32 8.862 6.874 13.318 1.00 65.21 H new ATOM 0 HB2 ASP A 32 7.523 7.789 15.244 1.00 45.02 H new ATOM 0 HB3 ASP A 32 7.721 9.398 14.578 1.00 45.02 H new ATOM 502 N PRO A 33 10.147 8.203 11.422 1.00 75.44 N ATOM 503 CA PRO A 33 10.461 8.910 10.164 1.00 20.23 C ATOM 504 C PRO A 33 9.213 9.158 9.286 1.00 44.11 C ATOM 505 O PRO A 33 9.198 10.098 8.496 1.00 34.14 O ATOM 506 CB PRO A 33 11.516 8.007 9.463 1.00 64.45 C ATOM 507 CG PRO A 33 11.472 6.672 10.157 1.00 1.22 C ATOM 508 CD PRO A 33 10.842 6.892 11.517 1.00 14.42 C ATOM 0 HA PRO A 33 10.843 9.914 10.350 1.00 20.23 H new ATOM 0 HB2 PRO A 33 11.290 7.899 8.402 1.00 64.45 H new ATOM 0 HB3 PRO A 33 12.511 8.447 9.534 1.00 64.45 H new ATOM 0 HG2 PRO A 33 10.891 5.956 9.576 1.00 1.22 H new ATOM 0 HG3 PRO A 33 12.476 6.259 10.261 1.00 1.22 H new ATOM 0 HD2 PRO A 33 10.142 6.093 11.760 1.00 14.42 H new ATOM 0 HD3 PRO A 33 11.597 6.904 12.303 1.00 14.42 H new ATOM 516 N LEU A 34 8.156 8.338 9.477 1.00 64.11 N ATOM 517 CA LEU A 34 6.922 8.419 8.670 1.00 32.42 C ATOM 518 C LEU A 34 6.197 9.761 8.833 1.00 10.33 C ATOM 519 O LEU A 34 5.826 10.367 7.837 1.00 52.44 O ATOM 520 CB LEU A 34 5.974 7.253 9.000 1.00 62.43 C ATOM 521 CG LEU A 34 4.711 7.125 8.087 1.00 42.22 C ATOM 522 CD1 LEU A 34 5.086 6.982 6.589 1.00 42.21 C ATOM 523 CD2 LEU A 34 3.838 5.957 8.548 1.00 71.42 C ATOM 0 H LEU A 34 8.135 7.608 10.189 1.00 64.11 H new ATOM 0 HA LEU A 34 7.227 8.344 7.626 1.00 32.42 H new ATOM 0 HB2 LEU A 34 6.538 6.322 8.940 1.00 62.43 H new ATOM 0 HB3 LEU A 34 5.643 7.359 10.033 1.00 62.43 H new ATOM 0 HG LEU A 34 4.140 8.048 8.183 1.00 42.22 H new ATOM 0 HD11 LEU A 34 4.177 6.896 5.993 1.00 42.21 H new ATOM 0 HD12 LEU A 34 5.648 7.859 6.269 1.00 42.21 H new ATOM 0 HD13 LEU A 34 5.697 6.090 6.450 1.00 42.21 H new ATOM 0 HD21 LEU A 34 2.963 5.880 7.903 1.00 71.42 H new ATOM 0 HD22 LEU A 34 4.411 5.031 8.494 1.00 71.42 H new ATOM 0 HD23 LEU A 34 3.518 6.126 9.576 1.00 71.42 H new ATOM 535 N GLY A 35 6.034 10.222 10.084 1.00 41.02 N ATOM 536 CA GLY A 35 5.419 11.529 10.365 1.00 14.45 C ATOM 537 C GLY A 35 6.140 12.691 9.681 1.00 72.40 C ATOM 538 O GLY A 35 5.511 13.666 9.263 1.00 45.42 O ATOM 0 H GLY A 35 6.320 9.708 10.917 1.00 41.02 H new ATOM 0 HA2 GLY A 35 4.379 11.512 10.039 1.00 14.45 H new ATOM 0 HA3 GLY A 35 5.413 11.697 11.442 1.00 14.45 H new ATOM 542 N GLU A 36 7.469 12.550 9.555 1.00 32.21 N ATOM 543 CA GLU A 36 8.335 13.515 8.856 1.00 31.33 C ATOM 544 C GLU A 36 8.118 13.463 7.315 1.00 22.43 C ATOM 545 O GLU A 36 8.166 14.491 6.631 1.00 1.54 O ATOM 546 CB GLU A 36 9.815 13.221 9.209 1.00 62.45 C ATOM 547 CG GLU A 36 10.805 14.334 8.817 1.00 61.12 C ATOM 548 CD GLU A 36 10.611 15.606 9.655 1.00 4.20 C ATOM 549 OE1 GLU A 36 11.079 15.626 10.815 1.00 2.25 O ATOM 550 OE2 GLU A 36 9.981 16.574 9.174 1.00 61.10 O ATOM 0 H GLU A 36 7.979 11.755 9.939 1.00 32.21 H new ATOM 0 HA GLU A 36 8.074 14.521 9.185 1.00 31.33 H new ATOM 0 HB2 GLU A 36 9.891 13.048 10.283 1.00 62.45 H new ATOM 0 HB3 GLU A 36 10.115 12.297 8.715 1.00 62.45 H new ATOM 0 HG2 GLU A 36 11.825 13.971 8.942 1.00 61.12 H new ATOM 0 HG3 GLU A 36 10.679 14.574 7.761 1.00 61.12 H new ATOM 557 N TRP A 37 7.891 12.249 6.787 1.00 1.22 N ATOM 558 CA TRP A 37 7.511 12.034 5.370 1.00 52.53 C ATOM 559 C TRP A 37 6.116 12.639 5.051 1.00 61.31 C ATOM 560 O TRP A 37 5.931 13.236 3.996 1.00 42.41 O ATOM 561 CB TRP A 37 7.504 10.517 5.033 1.00 13.23 C ATOM 562 CG TRP A 37 8.854 9.940 4.679 1.00 32.22 C ATOM 563 CD1 TRP A 37 9.806 9.454 5.525 1.00 62.32 C ATOM 564 CD2 TRP A 37 9.380 9.777 3.362 1.00 61.12 C ATOM 565 NE1 TRP A 37 10.882 8.997 4.816 1.00 40.13 N ATOM 566 CE2 TRP A 37 10.644 9.183 3.486 1.00 54.54 C ATOM 567 CE3 TRP A 37 8.895 10.079 2.086 1.00 33.10 C ATOM 568 CZ2 TRP A 37 11.429 8.878 2.388 1.00 71.12 C ATOM 569 CZ3 TRP A 37 9.677 9.778 0.999 1.00 24.03 C ATOM 570 CH2 TRP A 37 10.929 9.183 1.155 1.00 12.11 C ATOM 0 H TRP A 37 7.964 11.386 7.325 1.00 1.22 H new ATOM 0 HA TRP A 37 8.254 12.542 4.756 1.00 52.53 H new ATOM 0 HB2 TRP A 37 7.104 9.971 5.888 1.00 13.23 H new ATOM 0 HB3 TRP A 37 6.822 10.348 4.199 1.00 13.23 H new ATOM 0 HD1 TRP A 37 9.722 9.433 6.602 1.00 62.32 H new ATOM 0 HE1 TRP A 37 11.725 8.585 5.216 1.00 40.13 H new ATOM 0 HE3 TRP A 37 7.926 10.539 1.958 1.00 33.10 H new ATOM 0 HZ2 TRP A 37 12.399 8.417 2.502 1.00 71.12 H new ATOM 0 HZ3 TRP A 37 9.317 10.006 0.006 1.00 24.03 H new ATOM 0 HH2 TRP A 37 11.518 8.958 0.278 1.00 12.11 H new ATOM 581 N GLU A 38 5.158 12.473 5.989 1.00 63.14 N ATOM 582 CA GLU A 38 3.759 12.953 5.840 1.00 1.13 C ATOM 583 C GLU A 38 3.702 14.479 5.651 1.00 42.32 C ATOM 584 O GLU A 38 2.822 14.985 4.960 1.00 45.51 O ATOM 585 CB GLU A 38 2.907 12.538 7.067 1.00 73.23 C ATOM 586 CG GLU A 38 2.810 11.009 7.278 1.00 72.03 C ATOM 587 CD GLU A 38 2.022 10.581 8.526 1.00 14.45 C ATOM 588 OE1 GLU A 38 2.016 11.332 9.527 1.00 23.30 O ATOM 589 OE2 GLU A 38 1.452 9.468 8.540 1.00 44.44 O ATOM 0 H GLU A 38 5.330 12.001 6.876 1.00 63.14 H new ATOM 0 HA GLU A 38 3.347 12.486 4.946 1.00 1.13 H new ATOM 0 HB2 GLU A 38 3.333 12.992 7.962 1.00 73.23 H new ATOM 0 HB3 GLU A 38 1.902 12.943 6.952 1.00 73.23 H new ATOM 0 HG2 GLU A 38 2.343 10.564 6.400 1.00 72.03 H new ATOM 0 HG3 GLU A 38 3.818 10.600 7.344 1.00 72.03 H new ATOM 596 N ARG A 39 4.678 15.190 6.263 1.00 32.21 N ATOM 597 CA ARG A 39 4.870 16.647 6.062 1.00 34.43 C ATOM 598 C ARG A 39 5.063 16.961 4.551 1.00 71.53 C ATOM 599 O ARG A 39 4.482 17.907 4.021 1.00 40.55 O ATOM 600 CB ARG A 39 6.110 17.159 6.860 1.00 52.33 C ATOM 601 CG ARG A 39 6.197 16.700 8.337 1.00 73.42 C ATOM 602 CD ARG A 39 5.005 17.144 9.209 1.00 15.25 C ATOM 603 NE ARG A 39 5.106 16.622 10.589 1.00 23.42 N ATOM 604 CZ ARG A 39 4.308 16.951 11.590 1.00 62.13 C ATOM 605 NH1 ARG A 39 3.344 17.807 11.432 1.00 44.31 N ATOM 606 NH2 ARG A 39 4.482 16.414 12.753 1.00 1.11 N ATOM 0 H ARG A 39 5.351 14.774 6.906 1.00 32.21 H new ATOM 0 HA ARG A 39 3.979 17.158 6.429 1.00 34.43 H new ATOM 0 HB2 ARG A 39 7.012 16.831 6.343 1.00 52.33 H new ATOM 0 HB3 ARG A 39 6.109 18.249 6.837 1.00 52.33 H new ATOM 0 HG2 ARG A 39 6.267 15.613 8.364 1.00 73.42 H new ATOM 0 HG3 ARG A 39 7.117 17.090 8.773 1.00 73.42 H new ATOM 0 HD2 ARG A 39 4.960 18.233 9.235 1.00 15.25 H new ATOM 0 HD3 ARG A 39 4.076 16.797 8.757 1.00 15.25 H new ATOM 0 HE ARG A 39 5.852 15.954 10.784 1.00 23.42 H new ATOM 0 HH11 ARG A 39 3.191 18.240 10.521 1.00 44.31 H new ATOM 0 HH12 ARG A 39 2.740 18.046 12.219 1.00 44.31 H new ATOM 0 HH21 ARG A 39 5.233 15.739 12.896 1.00 1.11 H new ATOM 0 HH22 ARG A 39 3.868 16.665 13.528 1.00 1.11 H new ATOM 620 N TYR A 40 5.863 16.116 3.875 1.00 3.11 N ATOM 621 CA TYR A 40 6.179 16.256 2.435 1.00 71.04 C ATOM 622 C TYR A 40 5.054 15.728 1.518 1.00 31.42 C ATOM 623 O TYR A 40 4.834 16.303 0.460 1.00 51.33 O ATOM 624 CB TYR A 40 7.514 15.543 2.107 1.00 70.34 C ATOM 625 CG TYR A 40 8.747 16.321 2.581 1.00 61.13 C ATOM 626 CD1 TYR A 40 9.048 16.455 3.941 1.00 23.42 C ATOM 627 CD2 TYR A 40 9.603 16.938 1.662 1.00 15.22 C ATOM 628 CE1 TYR A 40 10.151 17.170 4.361 1.00 61.40 C ATOM 629 CE2 TYR A 40 10.704 17.648 2.085 1.00 33.21 C ATOM 630 CZ TYR A 40 10.973 17.763 3.431 1.00 2.25 C ATOM 631 OH TYR A 40 12.073 18.473 3.846 1.00 71.21 O ATOM 0 H TYR A 40 6.313 15.311 4.312 1.00 3.11 H new ATOM 0 HA TYR A 40 6.274 17.324 2.236 1.00 71.04 H new ATOM 0 HB2 TYR A 40 7.515 14.556 2.570 1.00 70.34 H new ATOM 0 HB3 TYR A 40 7.581 15.389 1.030 1.00 70.34 H new ATOM 0 HD1 TYR A 40 8.406 15.991 4.675 1.00 23.42 H new ATOM 0 HD2 TYR A 40 9.397 16.856 0.605 1.00 15.22 H new ATOM 0 HE1 TYR A 40 10.368 17.264 5.415 1.00 61.40 H new ATOM 0 HE2 TYR A 40 11.356 18.115 1.362 1.00 33.21 H new ATOM 0 HH TYR A 40 12.406 18.098 4.688 1.00 71.21 H new ATOM 641 N ILE A 41 4.362 14.635 1.912 1.00 61.20 N ATOM 642 CA ILE A 41 3.255 14.061 1.097 1.00 53.25 C ATOM 643 C ILE A 41 2.055 15.053 1.028 1.00 42.42 C ATOM 644 O ILE A 41 1.519 15.290 -0.057 1.00 74.52 O ATOM 645 CB ILE A 41 2.791 12.613 1.587 1.00 14.14 C ATOM 646 CG1 ILE A 41 3.739 11.466 1.067 1.00 73.23 C ATOM 647 CG2 ILE A 41 1.328 12.291 1.154 1.00 30.54 C ATOM 648 CD1 ILE A 41 5.195 11.534 1.499 1.00 5.44 C ATOM 0 H ILE A 41 4.545 14.133 2.781 1.00 61.20 H new ATOM 0 HA ILE A 41 3.649 13.918 0.091 1.00 53.25 H new ATOM 0 HB ILE A 41 2.846 12.646 2.675 1.00 14.14 H new ATOM 0 HG12 ILE A 41 3.330 10.511 1.398 1.00 73.23 H new ATOM 0 HG13 ILE A 41 3.707 11.466 -0.023 1.00 73.23 H new ATOM 0 HG21 ILE A 41 1.054 11.297 1.508 1.00 30.54 H new ATOM 0 HG22 ILE A 41 0.651 13.029 1.584 1.00 30.54 H new ATOM 0 HG23 ILE A 41 1.255 12.322 0.067 1.00 30.54 H new ATOM 0 HD11 ILE A 41 5.740 10.690 1.076 1.00 5.44 H new ATOM 0 HD12 ILE A 41 5.637 12.465 1.145 1.00 5.44 H new ATOM 0 HD13 ILE A 41 5.254 11.495 2.587 1.00 5.44 H new ATOM 660 N GLN A 42 1.648 15.648 2.180 1.00 13.34 N ATOM 661 CA GLN A 42 0.582 16.686 2.183 1.00 22.23 C ATOM 662 C GLN A 42 1.030 17.960 1.429 1.00 13.21 C ATOM 663 O GLN A 42 0.226 18.585 0.738 1.00 32.43 O ATOM 664 CB GLN A 42 0.126 17.068 3.618 1.00 1.32 C ATOM 665 CG GLN A 42 1.214 17.715 4.514 1.00 4.35 C ATOM 666 CD GLN A 42 0.659 18.687 5.561 1.00 60.02 C ATOM 667 OE1 GLN A 42 0.300 18.297 6.662 1.00 63.02 O ATOM 668 NE2 GLN A 42 0.586 19.961 5.216 1.00 71.34 N ATOM 0 H GLN A 42 2.032 15.433 3.100 1.00 13.34 H new ATOM 0 HA GLN A 42 -0.268 16.242 1.665 1.00 22.23 H new ATOM 0 HB2 GLN A 42 -0.715 17.758 3.542 1.00 1.32 H new ATOM 0 HB3 GLN A 42 -0.242 16.170 4.115 1.00 1.32 H new ATOM 0 HG2 GLN A 42 1.768 16.926 5.023 1.00 4.35 H new ATOM 0 HG3 GLN A 42 1.924 18.246 3.880 1.00 4.35 H new ATOM 0 HE21 GLN A 42 0.893 20.257 4.289 1.00 71.34 H new ATOM 0 HE22 GLN A 42 0.222 20.648 5.876 1.00 71.34 H new ATOM 677 N TRP A 43 2.329 18.306 1.564 1.00 20.51 N ATOM 678 CA TRP A 43 2.929 19.489 0.920 1.00 53.02 C ATOM 679 C TRP A 43 2.849 19.364 -0.618 1.00 74.12 C ATOM 680 O TRP A 43 2.316 20.224 -1.299 1.00 52.13 O ATOM 681 CB TRP A 43 4.408 19.653 1.368 1.00 53.45 C ATOM 682 CG TRP A 43 5.092 20.910 0.863 1.00 54.22 C ATOM 683 CD1 TRP A 43 5.041 22.156 1.427 1.00 3.53 C ATOM 684 CD2 TRP A 43 5.935 21.036 -0.298 1.00 63.23 C ATOM 685 NE1 TRP A 43 5.778 23.042 0.681 1.00 2.33 N ATOM 686 CE2 TRP A 43 6.338 22.379 -0.376 1.00 31.23 C ATOM 687 CE3 TRP A 43 6.378 20.142 -1.284 1.00 31.32 C ATOM 688 CZ2 TRP A 43 7.160 22.855 -1.394 1.00 0.32 C ATOM 689 CZ3 TRP A 43 7.202 20.613 -2.288 1.00 71.32 C ATOM 690 CH2 TRP A 43 7.585 21.959 -2.338 1.00 35.22 C ATOM 0 H TRP A 43 2.991 17.769 2.125 1.00 20.51 H new ATOM 0 HA TRP A 43 2.369 20.372 1.227 1.00 53.02 H new ATOM 0 HB2 TRP A 43 4.445 19.649 2.457 1.00 53.45 H new ATOM 0 HB3 TRP A 43 4.974 18.786 1.027 1.00 53.45 H new ATOM 0 HD1 TRP A 43 4.500 22.406 2.328 1.00 3.53 H new ATOM 0 HE1 TRP A 43 5.890 24.036 0.883 1.00 2.33 H new ATOM 0 HE3 TRP A 43 6.080 19.104 -1.259 1.00 31.32 H new ATOM 0 HZ2 TRP A 43 7.452 23.894 -1.437 1.00 0.32 H new ATOM 0 HZ3 TRP A 43 7.557 19.932 -3.047 1.00 71.32 H new ATOM 0 HH2 TRP A 43 8.228 22.297 -3.137 1.00 35.22 H new ATOM 701 N VAL A 44 3.358 18.255 -1.139 1.00 21.53 N ATOM 702 CA VAL A 44 3.425 18.006 -2.587 1.00 33.00 C ATOM 703 C VAL A 44 2.006 17.850 -3.222 1.00 50.34 C ATOM 704 O VAL A 44 1.837 18.059 -4.416 1.00 54.15 O ATOM 705 CB VAL A 44 4.352 16.773 -2.885 1.00 64.22 C ATOM 706 CG1 VAL A 44 3.734 15.453 -2.400 1.00 52.23 C ATOM 707 CG2 VAL A 44 4.739 16.710 -4.367 1.00 15.02 C ATOM 0 H VAL A 44 3.739 17.496 -0.574 1.00 21.53 H new ATOM 0 HA VAL A 44 3.870 18.881 -3.062 1.00 33.00 H new ATOM 0 HB VAL A 44 5.269 16.916 -2.313 1.00 64.22 H new ATOM 0 HG11 VAL A 44 4.411 14.629 -2.628 1.00 52.23 H new ATOM 0 HG12 VAL A 44 3.571 15.502 -1.323 1.00 52.23 H new ATOM 0 HG13 VAL A 44 2.782 15.290 -2.904 1.00 52.23 H new ATOM 0 HG21 VAL A 44 5.380 15.846 -4.539 1.00 15.02 H new ATOM 0 HG22 VAL A 44 3.839 16.620 -4.975 1.00 15.02 H new ATOM 0 HG23 VAL A 44 5.274 17.619 -4.642 1.00 15.02 H new ATOM 717 N GLU A 45 0.996 17.502 -2.395 1.00 11.23 N ATOM 718 CA GLU A 45 -0.427 17.492 -2.816 1.00 42.30 C ATOM 719 C GLU A 45 -1.009 18.921 -2.949 1.00 44.00 C ATOM 720 O GLU A 45 -1.547 19.286 -4.005 1.00 10.12 O ATOM 721 CB GLU A 45 -1.282 16.646 -1.823 1.00 31.12 C ATOM 722 CG GLU A 45 -1.096 15.118 -1.947 1.00 43.13 C ATOM 723 CD GLU A 45 -1.709 14.531 -3.239 1.00 41.42 C ATOM 724 OE1 GLU A 45 -1.199 14.813 -4.344 1.00 61.50 O ATOM 725 OE2 GLU A 45 -2.717 13.794 -3.154 1.00 63.31 O ATOM 0 H GLU A 45 1.139 17.222 -1.425 1.00 11.23 H new ATOM 0 HA GLU A 45 -0.468 17.034 -3.804 1.00 42.30 H new ATOM 0 HB2 GLU A 45 -1.034 16.947 -0.805 1.00 31.12 H new ATOM 0 HB3 GLU A 45 -2.334 16.883 -1.978 1.00 31.12 H new ATOM 0 HG2 GLU A 45 -0.032 14.885 -1.920 1.00 43.13 H new ATOM 0 HG3 GLU A 45 -1.551 14.632 -1.084 1.00 43.13 H new ATOM 732 N GLU A 46 -0.902 19.719 -1.868 1.00 51.23 N ATOM 733 CA GLU A 46 -1.474 21.092 -1.809 1.00 42.44 C ATOM 734 C GLU A 46 -0.772 22.066 -2.800 1.00 43.24 C ATOM 735 O GLU A 46 -1.406 22.969 -3.356 1.00 43.33 O ATOM 736 CB GLU A 46 -1.398 21.641 -0.351 1.00 61.13 C ATOM 737 CG GLU A 46 0.030 21.778 0.204 1.00 54.31 C ATOM 738 CD GLU A 46 0.105 22.226 1.671 1.00 71.13 C ATOM 739 OE1 GLU A 46 0.037 23.445 1.934 1.00 21.53 O ATOM 740 OE2 GLU A 46 0.249 21.359 2.563 1.00 34.00 O ATOM 0 H GLU A 46 -0.421 19.439 -1.013 1.00 51.23 H new ATOM 0 HA GLU A 46 -2.518 21.027 -2.114 1.00 42.44 H new ATOM 0 HB2 GLU A 46 -1.883 22.617 -0.318 1.00 61.13 H new ATOM 0 HB3 GLU A 46 -1.967 20.980 0.303 1.00 61.13 H new ATOM 0 HG2 GLU A 46 0.538 20.819 0.104 1.00 54.31 H new ATOM 0 HG3 GLU A 46 0.577 22.494 -0.409 1.00 54.31 H new ATOM 747 N ASN A 47 0.542 21.859 -3.007 1.00 60.13 N ATOM 748 CA ASN A 47 1.364 22.671 -3.929 1.00 13.32 C ATOM 749 C ASN A 47 1.309 22.140 -5.384 1.00 3.20 C ATOM 750 O ASN A 47 1.315 22.932 -6.331 1.00 44.45 O ATOM 751 CB ASN A 47 2.834 22.731 -3.426 1.00 13.13 C ATOM 752 CG ASN A 47 3.000 23.597 -2.171 1.00 62.12 C ATOM 753 OD1 ASN A 47 3.209 24.797 -2.252 1.00 22.22 O ATOM 754 ND2 ASN A 47 2.919 23.003 -1.011 1.00 61.14 N ATOM 0 H ASN A 47 1.067 21.121 -2.538 1.00 60.13 H new ATOM 0 HA ASN A 47 0.946 23.678 -3.939 1.00 13.32 H new ATOM 0 HB2 ASN A 47 3.181 21.720 -3.212 1.00 13.13 H new ATOM 0 HB3 ASN A 47 3.469 23.125 -4.220 1.00 13.13 H new ATOM 0 HD21 ASN A 47 3.031 23.543 -0.153 1.00 61.14 H new ATOM 0 HD22 ASN A 47 2.744 21.999 -0.963 1.00 61.14 H new ATOM 761 N PHE A 48 1.261 20.797 -5.569 1.00 13.52 N ATOM 762 CA PHE A 48 1.264 20.165 -6.927 1.00 30.35 C ATOM 763 C PHE A 48 0.094 19.139 -7.070 1.00 15.53 C ATOM 764 O PHE A 48 0.307 17.925 -6.973 1.00 64.43 O ATOM 765 CB PHE A 48 2.644 19.490 -7.215 1.00 12.31 C ATOM 766 CG PHE A 48 3.852 20.401 -6.964 1.00 54.12 C ATOM 767 CD1 PHE A 48 4.207 21.389 -7.883 1.00 35.01 C ATOM 768 CD2 PHE A 48 4.614 20.288 -5.798 1.00 42.04 C ATOM 769 CE1 PHE A 48 5.283 22.228 -7.647 1.00 13.03 C ATOM 770 CE2 PHE A 48 5.689 21.130 -5.565 1.00 60.41 C ATOM 771 CZ PHE A 48 6.022 22.099 -6.489 1.00 4.13 C ATOM 0 H PHE A 48 1.220 20.126 -4.802 1.00 13.52 H new ATOM 0 HA PHE A 48 1.109 20.949 -7.669 1.00 30.35 H new ATOM 0 HB2 PHE A 48 2.738 18.600 -6.592 1.00 12.31 H new ATOM 0 HB3 PHE A 48 2.664 19.156 -8.253 1.00 12.31 H new ATOM 0 HD1 PHE A 48 3.634 21.501 -8.792 1.00 35.01 H new ATOM 0 HD2 PHE A 48 4.361 19.533 -5.068 1.00 42.04 H new ATOM 0 HE1 PHE A 48 5.544 22.985 -8.371 1.00 13.03 H new ATOM 0 HE2 PHE A 48 6.267 21.028 -4.659 1.00 60.41 H new ATOM 0 HZ PHE A 48 6.860 22.756 -6.306 1.00 4.13 H new ATOM 781 N PRO A 49 -1.178 19.619 -7.266 1.00 12.23 N ATOM 782 CA PRO A 49 -2.350 18.722 -7.439 1.00 21.04 C ATOM 783 C PRO A 49 -2.369 17.996 -8.814 1.00 23.40 C ATOM 784 O PRO A 49 -2.608 16.785 -8.879 1.00 30.13 O ATOM 785 CB PRO A 49 -3.553 19.685 -7.273 1.00 22.02 C ATOM 786 CG PRO A 49 -3.035 21.029 -7.699 1.00 14.02 C ATOM 787 CD PRO A 49 -1.576 21.060 -7.287 1.00 14.43 C ATOM 0 HA PRO A 49 -2.350 17.900 -6.723 1.00 21.04 H new ATOM 0 HB2 PRO A 49 -4.396 19.373 -7.889 1.00 22.02 H new ATOM 0 HB3 PRO A 49 -3.903 19.706 -6.241 1.00 22.02 H new ATOM 0 HG2 PRO A 49 -3.140 21.165 -8.775 1.00 14.02 H new ATOM 0 HG3 PRO A 49 -3.594 21.833 -7.220 1.00 14.02 H new ATOM 0 HD2 PRO A 49 -0.973 21.631 -7.994 1.00 14.43 H new ATOM 0 HD3 PRO A 49 -1.447 21.525 -6.310 1.00 14.43 H new ATOM 795 N GLU A 50 -2.123 18.744 -9.907 1.00 14.11 N ATOM 796 CA GLU A 50 -2.138 18.188 -11.281 1.00 15.43 C ATOM 797 C GLU A 50 -0.899 17.309 -11.557 1.00 50.43 C ATOM 798 O GLU A 50 -1.032 16.181 -12.047 1.00 75.44 O ATOM 799 CB GLU A 50 -2.250 19.323 -12.325 1.00 65.10 C ATOM 800 CG GLU A 50 -3.530 20.172 -12.185 1.00 74.22 C ATOM 801 CD GLU A 50 -3.644 21.275 -13.251 1.00 22.34 C ATOM 802 OE1 GLU A 50 -2.821 22.213 -13.229 1.00 61.34 O ATOM 803 OE2 GLU A 50 -4.558 21.215 -14.109 1.00 12.30 O ATOM 0 H GLU A 50 -1.910 19.741 -9.868 1.00 14.11 H new ATOM 0 HA GLU A 50 -3.016 17.548 -11.368 1.00 15.43 H new ATOM 0 HB2 GLU A 50 -1.381 19.975 -12.234 1.00 65.10 H new ATOM 0 HB3 GLU A 50 -2.220 18.889 -13.325 1.00 65.10 H new ATOM 0 HG2 GLU A 50 -4.400 19.519 -12.252 1.00 74.22 H new ATOM 0 HG3 GLU A 50 -3.549 20.628 -11.195 1.00 74.22 H new ATOM 810 N ASN A 51 0.302 17.834 -11.248 1.00 0.40 N ATOM 811 CA ASN A 51 1.562 17.074 -11.366 1.00 62.05 C ATOM 812 C ASN A 51 1.684 16.031 -10.232 1.00 43.34 C ATOM 813 O ASN A 51 2.288 16.281 -9.181 1.00 21.50 O ATOM 814 CB ASN A 51 2.796 18.006 -11.378 1.00 23.00 C ATOM 815 CG ASN A 51 2.893 18.903 -12.611 1.00 33.20 C ATOM 816 OD1 ASN A 51 2.377 18.593 -13.679 1.00 4.20 O ATOM 817 ND2 ASN A 51 3.607 20.000 -12.486 1.00 55.44 N ATOM 0 H ASN A 51 0.427 18.789 -10.912 1.00 0.40 H new ATOM 0 HA ASN A 51 1.534 16.549 -12.321 1.00 62.05 H new ATOM 0 HB2 ASN A 51 2.772 18.634 -10.487 1.00 23.00 H new ATOM 0 HB3 ASN A 51 3.698 17.397 -11.314 1.00 23.00 H new ATOM 0 HD21 ASN A 51 3.742 20.615 -13.288 1.00 55.44 H new ATOM 0 HD22 ASN A 51 4.026 20.236 -11.587 1.00 55.44 H new ATOM 824 N LYS A 52 1.073 14.861 -10.460 1.00 62.22 N ATOM 825 CA LYS A 52 1.146 13.715 -9.540 1.00 4.42 C ATOM 826 C LYS A 52 2.517 13.024 -9.601 1.00 32.20 C ATOM 827 O LYS A 52 2.893 12.368 -8.649 1.00 43.25 O ATOM 828 CB LYS A 52 -0.010 12.718 -9.837 1.00 11.35 C ATOM 829 CG LYS A 52 -1.357 13.117 -9.192 1.00 55.32 C ATOM 830 CD LYS A 52 -1.344 12.921 -7.656 1.00 2.23 C ATOM 831 CE LYS A 52 -2.633 13.404 -6.963 1.00 62.03 C ATOM 832 NZ LYS A 52 -2.687 14.882 -6.858 1.00 55.30 N ATOM 0 H LYS A 52 0.511 14.681 -11.292 1.00 62.22 H new ATOM 0 HA LYS A 52 1.028 14.086 -8.522 1.00 4.42 H new ATOM 0 HB2 LYS A 52 -0.143 12.641 -10.916 1.00 11.35 H new ATOM 0 HB3 LYS A 52 0.275 11.729 -9.479 1.00 11.35 H new ATOM 0 HG2 LYS A 52 -1.575 14.160 -9.423 1.00 55.32 H new ATOM 0 HG3 LYS A 52 -2.158 12.520 -9.627 1.00 55.32 H new ATOM 0 HD2 LYS A 52 -1.196 11.864 -7.434 1.00 2.23 H new ATOM 0 HD3 LYS A 52 -0.493 13.457 -7.237 1.00 2.23 H new ATOM 0 HE2 LYS A 52 -3.499 13.048 -7.521 1.00 62.03 H new ATOM 0 HE3 LYS A 52 -2.694 12.967 -5.966 1.00 62.03 H new ATOM 0 HZ1 LYS A 52 -3.653 15.177 -6.610 1.00 55.30 H new ATOM 0 HZ2 LYS A 52 -2.027 15.202 -6.121 1.00 55.30 H new ATOM 0 HZ3 LYS A 52 -2.419 15.305 -7.770 1.00 55.30 H new ATOM 846 N GLU A 53 3.272 13.226 -10.703 1.00 45.04 N ATOM 847 CA GLU A 53 4.658 12.700 -10.858 1.00 12.24 C ATOM 848 C GLU A 53 5.562 13.157 -9.691 1.00 12.04 C ATOM 849 O GLU A 53 6.477 12.441 -9.278 1.00 35.41 O ATOM 850 CB GLU A 53 5.258 13.170 -12.210 1.00 65.31 C ATOM 851 CG GLU A 53 5.283 14.699 -12.393 1.00 0.24 C ATOM 852 CD GLU A 53 5.889 15.135 -13.730 1.00 75.42 C ATOM 853 OE1 GLU A 53 5.177 15.081 -14.758 1.00 23.43 O ATOM 854 OE2 GLU A 53 7.076 15.521 -13.763 1.00 2.12 O ATOM 0 H GLU A 53 2.945 13.756 -11.511 1.00 45.04 H new ATOM 0 HA GLU A 53 4.610 11.611 -10.844 1.00 12.24 H new ATOM 0 HB2 GLU A 53 6.276 12.789 -12.295 1.00 65.31 H new ATOM 0 HB3 GLU A 53 4.683 12.727 -13.023 1.00 65.31 H new ATOM 0 HG2 GLU A 53 4.266 15.084 -12.319 1.00 0.24 H new ATOM 0 HG3 GLU A 53 5.853 15.147 -11.579 1.00 0.24 H new ATOM 861 N TYR A 54 5.263 14.358 -9.172 1.00 10.24 N ATOM 862 CA TYR A 54 5.881 14.891 -7.965 1.00 23.45 C ATOM 863 C TYR A 54 5.578 13.995 -6.732 1.00 62.21 C ATOM 864 O TYR A 54 6.499 13.422 -6.153 1.00 61.41 O ATOM 865 CB TYR A 54 5.414 16.349 -7.732 1.00 72.24 C ATOM 866 CG TYR A 54 6.113 17.413 -8.595 1.00 55.31 C ATOM 867 CD1 TYR A 54 6.019 17.409 -9.987 1.00 14.34 C ATOM 868 CD2 TYR A 54 6.864 18.431 -8.003 1.00 34.01 C ATOM 869 CE1 TYR A 54 6.644 18.381 -10.752 1.00 72.35 C ATOM 870 CE2 TYR A 54 7.479 19.399 -8.762 1.00 32.34 C ATOM 871 CZ TYR A 54 7.369 19.374 -10.131 1.00 53.30 C ATOM 872 OH TYR A 54 7.989 20.348 -10.883 1.00 34.20 O ATOM 0 H TYR A 54 4.577 14.987 -9.589 1.00 10.24 H new ATOM 0 HA TYR A 54 6.963 14.892 -8.101 1.00 23.45 H new ATOM 0 HB2 TYR A 54 4.341 16.403 -7.918 1.00 72.24 H new ATOM 0 HB3 TYR A 54 5.569 16.598 -6.682 1.00 72.24 H new ATOM 0 HD1 TYR A 54 5.449 16.634 -10.477 1.00 14.34 H new ATOM 0 HD2 TYR A 54 6.964 18.459 -6.928 1.00 34.01 H new ATOM 0 HE1 TYR A 54 6.563 18.360 -11.829 1.00 72.35 H new ATOM 0 HE2 TYR A 54 8.049 20.180 -8.281 1.00 32.34 H new ATOM 0 HH TYR A 54 8.794 20.657 -10.418 1.00 34.20 H new ATOM 882 N LEU A 55 4.276 13.859 -6.388 1.00 43.23 N ATOM 883 CA LEU A 55 3.802 13.025 -5.249 1.00 35.15 C ATOM 884 C LEU A 55 4.342 11.575 -5.320 1.00 64.53 C ATOM 885 O LEU A 55 4.878 11.058 -4.339 1.00 50.34 O ATOM 886 CB LEU A 55 2.243 12.989 -5.219 1.00 20.41 C ATOM 887 CG LEU A 55 1.597 12.007 -4.178 1.00 3.54 C ATOM 888 CD1 LEU A 55 1.767 12.494 -2.724 1.00 43.24 C ATOM 889 CD2 LEU A 55 0.128 11.721 -4.515 1.00 42.00 C ATOM 0 H LEU A 55 3.520 14.324 -6.891 1.00 43.23 H new ATOM 0 HA LEU A 55 4.185 13.485 -4.338 1.00 35.15 H new ATOM 0 HB2 LEU A 55 1.880 13.996 -5.013 1.00 20.41 H new ATOM 0 HB3 LEU A 55 1.886 12.719 -6.213 1.00 20.41 H new ATOM 0 HG LEU A 55 2.141 11.065 -4.253 1.00 3.54 H new ATOM 0 HD11 LEU A 55 1.303 11.779 -2.044 1.00 43.24 H new ATOM 0 HD12 LEU A 55 2.828 12.580 -2.491 1.00 43.24 H new ATOM 0 HD13 LEU A 55 1.290 13.467 -2.608 1.00 43.24 H new ATOM 0 HD21 LEU A 55 -0.289 11.038 -3.775 1.00 42.00 H new ATOM 0 HD22 LEU A 55 -0.436 12.654 -4.506 1.00 42.00 H new ATOM 0 HD23 LEU A 55 0.063 11.268 -5.504 1.00 42.00 H new ATOM 901 N ILE A 56 4.204 10.964 -6.510 1.00 44.21 N ATOM 902 CA ILE A 56 4.599 9.572 -6.783 1.00 52.50 C ATOM 903 C ILE A 56 6.089 9.330 -6.451 1.00 31.54 C ATOM 904 O ILE A 56 6.404 8.336 -5.835 1.00 63.03 O ATOM 905 CB ILE A 56 4.299 9.178 -8.279 1.00 55.31 C ATOM 906 CG1 ILE A 56 2.775 9.321 -8.593 1.00 72.51 C ATOM 907 CG2 ILE A 56 4.778 7.742 -8.592 1.00 73.12 C ATOM 908 CD1 ILE A 56 2.408 9.141 -10.057 1.00 40.41 C ATOM 0 H ILE A 56 3.807 11.433 -7.324 1.00 44.21 H new ATOM 0 HA ILE A 56 4.001 8.934 -6.133 1.00 52.50 H new ATOM 0 HB ILE A 56 4.855 9.865 -8.917 1.00 55.31 H new ATOM 0 HG12 ILE A 56 2.226 8.588 -8.002 1.00 72.51 H new ATOM 0 HG13 ILE A 56 2.442 10.307 -8.268 1.00 72.51 H new ATOM 0 HG21 ILE A 56 4.556 7.503 -9.632 1.00 73.12 H new ATOM 0 HG22 ILE A 56 5.853 7.673 -8.426 1.00 73.12 H new ATOM 0 HG23 ILE A 56 4.264 7.037 -7.939 1.00 73.12 H new ATOM 0 HD11 ILE A 56 1.331 9.257 -10.179 1.00 40.41 H new ATOM 0 HD12 ILE A 56 2.924 9.891 -10.656 1.00 40.41 H new ATOM 0 HD13 ILE A 56 2.705 8.145 -10.387 1.00 40.41 H new ATOM 920 N THR A 57 6.973 10.282 -6.827 1.00 30.21 N ATOM 921 CA THR A 57 8.437 10.218 -6.528 1.00 11.52 C ATOM 922 C THR A 57 8.713 9.997 -5.021 1.00 72.12 C ATOM 923 O THR A 57 9.532 9.146 -4.641 1.00 64.01 O ATOM 924 CB THR A 57 9.156 11.529 -6.999 1.00 45.42 C ATOM 925 OG1 THR A 57 9.046 11.663 -8.425 1.00 1.42 O ATOM 926 CG2 THR A 57 10.643 11.594 -6.601 1.00 40.32 C ATOM 0 H THR A 57 6.701 11.117 -7.345 1.00 30.21 H new ATOM 0 HA THR A 57 8.834 9.364 -7.077 1.00 11.52 H new ATOM 0 HB THR A 57 8.652 12.351 -6.490 1.00 45.42 H new ATOM 0 HG1 THR A 57 8.138 11.948 -8.658 1.00 1.42 H new ATOM 0 HG21 THR A 57 11.075 12.528 -6.960 1.00 40.32 H new ATOM 0 HG22 THR A 57 10.732 11.547 -5.516 1.00 40.32 H new ATOM 0 HG23 THR A 57 11.176 10.753 -7.046 1.00 40.32 H new ATOM 934 N LEU A 58 7.999 10.771 -4.179 1.00 3.35 N ATOM 935 CA LEU A 58 8.079 10.653 -2.709 1.00 44.10 C ATOM 936 C LEU A 58 7.575 9.257 -2.238 1.00 73.52 C ATOM 937 O LEU A 58 8.190 8.635 -1.384 1.00 23.43 O ATOM 938 CB LEU A 58 7.276 11.799 -2.011 1.00 23.13 C ATOM 939 CG LEU A 58 7.902 13.247 -2.044 1.00 53.02 C ATOM 940 CD1 LEU A 58 9.294 13.284 -1.396 1.00 54.11 C ATOM 941 CD2 LEU A 58 7.935 13.864 -3.461 1.00 22.23 C ATOM 0 H LEU A 58 7.353 11.493 -4.497 1.00 3.35 H new ATOM 0 HA LEU A 58 9.125 10.751 -2.420 1.00 44.10 H new ATOM 0 HB2 LEU A 58 6.289 11.848 -2.471 1.00 23.13 H new ATOM 0 HB3 LEU A 58 7.128 11.520 -0.968 1.00 23.13 H new ATOM 0 HG LEU A 58 7.234 13.869 -1.448 1.00 53.02 H new ATOM 0 HD11 LEU A 58 9.689 14.299 -1.440 1.00 54.11 H new ATOM 0 HD12 LEU A 58 9.219 12.968 -0.355 1.00 54.11 H new ATOM 0 HD13 LEU A 58 9.963 12.611 -1.932 1.00 54.11 H new ATOM 0 HD21 LEU A 58 8.377 14.859 -3.414 1.00 22.23 H new ATOM 0 HD22 LEU A 58 8.532 13.233 -4.119 1.00 22.23 H new ATOM 0 HD23 LEU A 58 6.919 13.936 -3.850 1.00 22.23 H new ATOM 953 N LEU A 59 6.488 8.768 -2.862 1.00 75.30 N ATOM 954 CA LEU A 59 5.848 7.466 -2.520 1.00 53.31 C ATOM 955 C LEU A 59 6.730 6.236 -2.903 1.00 2.11 C ATOM 956 O LEU A 59 6.762 5.237 -2.176 1.00 4.33 O ATOM 957 CB LEU A 59 4.467 7.378 -3.212 1.00 11.23 C ATOM 958 CG LEU A 59 3.427 8.469 -2.802 1.00 2.11 C ATOM 959 CD1 LEU A 59 2.176 8.395 -3.696 1.00 20.40 C ATOM 960 CD2 LEU A 59 3.057 8.366 -1.298 1.00 52.34 C ATOM 0 H LEU A 59 6.020 9.261 -3.623 1.00 75.30 H new ATOM 0 HA LEU A 59 5.729 7.432 -1.437 1.00 53.31 H new ATOM 0 HB2 LEU A 59 4.618 7.435 -4.290 1.00 11.23 H new ATOM 0 HB3 LEU A 59 4.039 6.398 -3.001 1.00 11.23 H new ATOM 0 HG LEU A 59 3.889 9.445 -2.953 1.00 2.11 H new ATOM 0 HD11 LEU A 59 1.466 9.164 -3.392 1.00 20.40 H new ATOM 0 HD12 LEU A 59 2.462 8.555 -4.736 1.00 20.40 H new ATOM 0 HD13 LEU A 59 1.714 7.413 -3.594 1.00 20.40 H new ATOM 0 HD21 LEU A 59 2.332 9.140 -1.048 1.00 52.34 H new ATOM 0 HD22 LEU A 59 2.626 7.386 -1.096 1.00 52.34 H new ATOM 0 HD23 LEU A 59 3.954 8.500 -0.693 1.00 52.34 H new ATOM 972 N GLU A 60 7.407 6.316 -4.065 1.00 13.02 N ATOM 973 CA GLU A 60 8.400 5.308 -4.511 1.00 53.22 C ATOM 974 C GLU A 60 9.535 5.151 -3.477 1.00 54.21 C ATOM 975 O GLU A 60 9.883 4.041 -3.069 1.00 1.11 O ATOM 976 CB GLU A 60 9.014 5.717 -5.882 1.00 23.44 C ATOM 977 CG GLU A 60 7.991 5.928 -7.015 1.00 35.51 C ATOM 978 CD GLU A 60 8.617 6.290 -8.373 1.00 13.50 C ATOM 979 OE1 GLU A 60 9.061 7.443 -8.540 1.00 32.33 O ATOM 980 OE2 GLU A 60 8.683 5.418 -9.270 1.00 44.22 O ATOM 0 H GLU A 60 7.283 7.083 -4.726 1.00 13.02 H new ATOM 0 HA GLU A 60 7.879 4.356 -4.613 1.00 53.22 H new ATOM 0 HB2 GLU A 60 9.582 6.638 -5.749 1.00 23.44 H new ATOM 0 HB3 GLU A 60 9.722 4.948 -6.190 1.00 23.44 H new ATOM 0 HG2 GLU A 60 7.402 5.018 -7.131 1.00 35.51 H new ATOM 0 HG3 GLU A 60 7.301 6.720 -6.723 1.00 35.51 H new ATOM 987 N HIS A 61 10.110 6.292 -3.073 1.00 21.12 N ATOM 988 CA HIS A 61 11.229 6.339 -2.111 1.00 23.43 C ATOM 989 C HIS A 61 10.750 6.063 -0.671 1.00 41.21 C ATOM 990 O HIS A 61 11.543 5.661 0.174 1.00 24.14 O ATOM 991 CB HIS A 61 11.919 7.716 -2.188 1.00 74.21 C ATOM 992 CG HIS A 61 13.327 7.755 -1.662 1.00 2.04 C ATOM 993 ND1 HIS A 61 14.410 7.546 -2.471 1.00 33.43 N ATOM 994 CD2 HIS A 61 13.835 8.005 -0.427 1.00 0.00 C ATOM 995 CE1 HIS A 61 15.507 7.664 -1.775 1.00 11.12 C ATOM 996 NE2 HIS A 61 15.191 7.941 -0.533 1.00 50.31 N ATOM 0 H HIS A 61 9.815 7.211 -3.402 1.00 21.12 H new ATOM 0 HA HIS A 61 11.941 5.557 -2.377 1.00 23.43 H new ATOM 0 HB2 HIS A 61 11.927 8.043 -3.228 1.00 74.21 H new ATOM 0 HB3 HIS A 61 11.320 8.437 -1.632 1.00 74.21 H new ATOM 0 HD2 HIS A 61 13.270 8.215 0.469 1.00 0.00 H new ATOM 0 HE1 HIS A 61 16.510 7.552 -2.159 1.00 11.12 H new ATOM 0 HE2 HIS A 61 15.853 8.085 0.229 1.00 50.31 H new ATOM 1005 N LEU A 62 9.453 6.321 -0.418 1.00 43.41 N ATOM 1006 CA LEU A 62 8.786 6.051 0.869 1.00 42.21 C ATOM 1007 C LEU A 62 8.876 4.558 1.220 1.00 63.13 C ATOM 1008 O LEU A 62 9.433 4.194 2.246 1.00 22.11 O ATOM 1009 CB LEU A 62 7.301 6.474 0.775 1.00 40.42 C ATOM 1010 CG LEU A 62 6.420 6.261 2.047 1.00 10.41 C ATOM 1011 CD1 LEU A 62 6.636 7.370 3.089 1.00 60.31 C ATOM 1012 CD2 LEU A 62 4.944 6.132 1.671 1.00 35.21 C ATOM 0 H LEU A 62 8.829 6.730 -1.114 1.00 43.41 H new ATOM 0 HA LEU A 62 9.284 6.623 1.652 1.00 42.21 H new ATOM 0 HB2 LEU A 62 7.266 7.531 0.512 1.00 40.42 H new ATOM 0 HB3 LEU A 62 6.844 5.926 -0.049 1.00 40.42 H new ATOM 0 HG LEU A 62 6.736 5.326 2.509 1.00 10.41 H new ATOM 0 HD11 LEU A 62 6.004 7.182 3.957 1.00 60.31 H new ATOM 0 HD12 LEU A 62 7.681 7.381 3.397 1.00 60.31 H new ATOM 0 HD13 LEU A 62 6.376 8.335 2.653 1.00 60.31 H new ATOM 0 HD21 LEU A 62 4.350 5.984 2.573 1.00 35.21 H new ATOM 0 HD22 LEU A 62 4.617 7.041 1.166 1.00 35.21 H new ATOM 0 HD23 LEU A 62 4.811 5.279 1.006 1.00 35.21 H new ATOM 1024 N MET A 63 8.353 3.698 0.330 1.00 0.35 N ATOM 1025 CA MET A 63 8.381 2.240 0.551 1.00 73.02 C ATOM 1026 C MET A 63 9.820 1.696 0.590 1.00 61.41 C ATOM 1027 O MET A 63 10.097 0.776 1.337 1.00 43.11 O ATOM 1028 CB MET A 63 7.526 1.483 -0.489 1.00 52.23 C ATOM 1029 CG MET A 63 7.898 1.731 -1.956 1.00 51.53 C ATOM 1030 SD MET A 63 7.019 0.646 -3.100 1.00 4.00 S ATOM 1031 CE MET A 63 5.347 0.702 -2.450 1.00 23.53 C ATOM 0 H MET A 63 7.909 3.983 -0.543 1.00 0.35 H new ATOM 0 HA MET A 63 7.936 2.062 1.530 1.00 73.02 H new ATOM 0 HB2 MET A 63 7.603 0.414 -0.288 1.00 52.23 H new ATOM 0 HB3 MET A 63 6.482 1.760 -0.345 1.00 52.23 H new ATOM 0 HG2 MET A 63 7.682 2.769 -2.209 1.00 51.53 H new ATOM 0 HG3 MET A 63 8.971 1.589 -2.082 1.00 51.53 H new ATOM 0 HE1 MET A 63 4.687 0.119 -3.092 1.00 23.53 H new ATOM 0 HE2 MET A 63 5.334 0.286 -1.443 1.00 23.53 H new ATOM 0 HE3 MET A 63 5.003 1.736 -2.420 1.00 23.53 H new ATOM 1041 N LYS A 64 10.725 2.305 -0.201 1.00 52.10 N ATOM 1042 CA LYS A 64 12.163 1.955 -0.182 1.00 4.20 C ATOM 1043 C LYS A 64 12.861 2.405 1.139 1.00 13.21 C ATOM 1044 O LYS A 64 13.822 1.771 1.568 1.00 52.31 O ATOM 1045 CB LYS A 64 12.882 2.540 -1.431 1.00 1.13 C ATOM 1046 CG LYS A 64 12.472 1.870 -2.774 1.00 44.22 C ATOM 1047 CD LYS A 64 13.386 2.275 -3.965 1.00 44.41 C ATOM 1048 CE LYS A 64 13.123 3.698 -4.489 1.00 11.25 C ATOM 1049 NZ LYS A 64 11.845 3.784 -5.252 1.00 23.52 N ATOM 0 H LYS A 64 10.487 3.043 -0.863 1.00 52.10 H new ATOM 0 HA LYS A 64 12.238 0.868 -0.219 1.00 4.20 H new ATOM 0 HB2 LYS A 64 12.671 3.608 -1.491 1.00 1.13 H new ATOM 0 HB3 LYS A 64 13.959 2.435 -1.299 1.00 1.13 H new ATOM 0 HG2 LYS A 64 12.499 0.787 -2.655 1.00 44.22 H new ATOM 0 HG3 LYS A 64 11.442 2.139 -3.007 1.00 44.22 H new ATOM 0 HD2 LYS A 64 14.428 2.198 -3.655 1.00 44.41 H new ATOM 0 HD3 LYS A 64 13.243 1.565 -4.779 1.00 44.41 H new ATOM 0 HE2 LYS A 64 13.092 4.393 -3.650 1.00 11.25 H new ATOM 0 HE3 LYS A 64 13.949 4.007 -5.129 1.00 11.25 H new ATOM 0 HZ1 LYS A 64 11.672 4.771 -5.529 1.00 23.52 H new ATOM 0 HZ2 LYS A 64 11.909 3.191 -6.104 1.00 23.52 H new ATOM 0 HZ3 LYS A 64 11.061 3.449 -4.656 1.00 23.52 H new ATOM 1063 N GLU A 65 12.356 3.486 1.772 1.00 51.31 N ATOM 1064 CA GLU A 65 12.831 3.966 3.099 1.00 40.11 C ATOM 1065 C GLU A 65 12.414 2.971 4.205 1.00 54.54 C ATOM 1066 O GLU A 65 13.253 2.418 4.927 1.00 55.33 O ATOM 1067 CB GLU A 65 12.228 5.378 3.383 1.00 3.52 C ATOM 1068 CG GLU A 65 12.423 5.956 4.812 1.00 54.34 C ATOM 1069 CD GLU A 65 13.871 6.351 5.141 1.00 25.33 C ATOM 1070 OE1 GLU A 65 14.256 7.510 4.871 1.00 31.02 O ATOM 1071 OE2 GLU A 65 14.623 5.509 5.679 1.00 62.40 O ATOM 0 H GLU A 65 11.606 4.055 1.381 1.00 51.31 H new ATOM 0 HA GLU A 65 13.919 4.035 3.092 1.00 40.11 H new ATOM 0 HB2 GLU A 65 12.662 6.081 2.672 1.00 3.52 H new ATOM 0 HB3 GLU A 65 11.158 5.337 3.178 1.00 3.52 H new ATOM 0 HG2 GLU A 65 11.784 6.832 4.927 1.00 54.34 H new ATOM 0 HG3 GLU A 65 12.086 5.218 5.539 1.00 54.34 H new ATOM 1078 N PHE A 66 11.102 2.706 4.278 1.00 63.24 N ATOM 1079 CA PHE A 66 10.507 1.844 5.317 1.00 32.05 C ATOM 1080 C PHE A 66 10.597 0.352 4.965 1.00 42.45 C ATOM 1081 O PHE A 66 10.067 -0.501 5.690 1.00 10.43 O ATOM 1082 CB PHE A 66 9.056 2.283 5.570 1.00 52.44 C ATOM 1083 CG PHE A 66 8.979 3.735 6.019 1.00 22.54 C ATOM 1084 CD1 PHE A 66 9.220 4.070 7.334 1.00 33.42 C ATOM 1085 CD2 PHE A 66 8.740 4.765 5.119 1.00 13.32 C ATOM 1086 CE1 PHE A 66 9.205 5.377 7.743 1.00 34.33 C ATOM 1087 CE2 PHE A 66 8.743 6.074 5.529 1.00 40.13 C ATOM 1088 CZ PHE A 66 8.971 6.378 6.840 1.00 45.15 C ATOM 0 H PHE A 66 10.420 3.082 3.619 1.00 63.24 H new ATOM 0 HA PHE A 66 11.083 1.965 6.235 1.00 32.05 H new ATOM 0 HB2 PHE A 66 8.472 2.152 4.659 1.00 52.44 H new ATOM 0 HB3 PHE A 66 8.609 1.642 6.330 1.00 52.44 H new ATOM 0 HD1 PHE A 66 9.424 3.290 8.053 1.00 33.42 H new ATOM 0 HD2 PHE A 66 8.549 4.532 4.082 1.00 13.32 H new ATOM 0 HE1 PHE A 66 9.378 5.618 8.781 1.00 34.33 H new ATOM 0 HE2 PHE A 66 8.565 6.864 4.815 1.00 40.13 H new ATOM 0 HZ PHE A 66 8.967 7.408 7.164 1.00 45.15 H new ATOM 1098 N LEU A 67 11.262 0.058 3.833 1.00 65.02 N ATOM 1099 CA LEU A 67 11.686 -1.303 3.471 1.00 4.13 C ATOM 1100 C LEU A 67 12.661 -1.859 4.535 1.00 3.33 C ATOM 1101 O LEU A 67 12.495 -2.983 5.008 1.00 33.44 O ATOM 1102 CB LEU A 67 12.315 -1.321 2.027 1.00 13.10 C ATOM 1103 CG LEU A 67 11.809 -2.453 1.069 1.00 3.45 C ATOM 1104 CD1 LEU A 67 10.270 -2.411 0.905 1.00 42.21 C ATOM 1105 CD2 LEU A 67 12.513 -2.388 -0.307 1.00 12.21 C ATOM 0 H LEU A 67 11.521 0.762 3.142 1.00 65.02 H new ATOM 0 HA LEU A 67 10.813 -1.956 3.451 1.00 4.13 H new ATOM 0 HB2 LEU A 67 12.118 -0.358 1.555 1.00 13.10 H new ATOM 0 HB3 LEU A 67 13.397 -1.413 2.125 1.00 13.10 H new ATOM 0 HG LEU A 67 12.069 -3.405 1.531 1.00 3.45 H new ATOM 0 HD11 LEU A 67 9.954 -3.210 0.234 1.00 42.21 H new ATOM 0 HD12 LEU A 67 9.797 -2.545 1.878 1.00 42.21 H new ATOM 0 HD13 LEU A 67 9.975 -1.448 0.488 1.00 42.21 H new ATOM 0 HD21 LEU A 67 12.138 -3.188 -0.946 1.00 12.21 H new ATOM 0 HD22 LEU A 67 12.310 -1.425 -0.774 1.00 12.21 H new ATOM 0 HD23 LEU A 67 13.588 -2.506 -0.172 1.00 12.21 H new ATOM 1117 N ASP A 68 13.657 -1.053 4.956 1.00 3.23 N ATOM 1118 CA ASP A 68 14.625 -1.466 5.995 1.00 25.24 C ATOM 1119 C ASP A 68 14.129 -1.098 7.415 1.00 14.14 C ATOM 1120 O ASP A 68 14.644 -1.628 8.407 1.00 14.21 O ATOM 1121 CB ASP A 68 15.998 -0.806 5.710 1.00 71.04 C ATOM 1122 CG ASP A 68 16.618 -1.296 4.394 1.00 63.35 C ATOM 1123 OD1 ASP A 68 16.187 -0.843 3.311 1.00 31.42 O ATOM 1124 OD2 ASP A 68 17.522 -2.156 4.434 1.00 51.03 O ATOM 0 H ASP A 68 13.813 -0.113 4.593 1.00 3.23 H new ATOM 0 HA ASP A 68 14.727 -2.551 5.960 1.00 25.24 H new ATOM 0 HB2 ASP A 68 15.877 0.277 5.671 1.00 71.04 H new ATOM 0 HB3 ASP A 68 16.680 -1.021 6.533 1.00 71.04 H new ATOM 1129 N LYS A 69 13.130 -0.191 7.513 1.00 23.53 N ATOM 1130 CA LYS A 69 12.404 0.065 8.775 1.00 52.15 C ATOM 1131 C LYS A 69 11.328 -1.033 8.979 1.00 61.23 C ATOM 1132 O LYS A 69 10.146 -0.841 8.675 1.00 63.15 O ATOM 1133 CB LYS A 69 11.756 1.476 8.773 1.00 74.30 C ATOM 1134 CG LYS A 69 12.726 2.653 8.521 1.00 55.41 C ATOM 1135 CD LYS A 69 13.872 2.720 9.559 1.00 23.44 C ATOM 1136 CE LYS A 69 14.670 4.038 9.490 1.00 2.11 C ATOM 1137 NZ LYS A 69 15.287 4.264 8.158 1.00 72.22 N ATOM 0 H LYS A 69 12.809 0.377 6.729 1.00 23.53 H new ATOM 0 HA LYS A 69 13.113 0.033 9.602 1.00 52.15 H new ATOM 0 HB2 LYS A 69 10.979 1.499 8.009 1.00 74.30 H new ATOM 0 HB3 LYS A 69 11.264 1.632 9.733 1.00 74.30 H new ATOM 0 HG2 LYS A 69 13.152 2.559 7.522 1.00 55.41 H new ATOM 0 HG3 LYS A 69 12.168 3.589 8.543 1.00 55.41 H new ATOM 0 HD2 LYS A 69 13.456 2.606 10.560 1.00 23.44 H new ATOM 0 HD3 LYS A 69 14.550 1.882 9.398 1.00 23.44 H new ATOM 0 HE2 LYS A 69 14.008 4.872 9.726 1.00 2.11 H new ATOM 0 HE3 LYS A 69 15.451 4.026 10.250 1.00 2.11 H new ATOM 0 HZ1 LYS A 69 16.172 4.798 8.272 1.00 72.22 H new ATOM 0 HZ2 LYS A 69 15.490 3.348 7.710 1.00 72.22 H new ATOM 0 HZ3 LYS A 69 14.631 4.805 7.559 1.00 72.22 H new ATOM 1151 N LYS A 70 11.769 -2.200 9.480 1.00 30.53 N ATOM 1152 CA LYS A 70 10.927 -3.417 9.590 1.00 23.42 C ATOM 1153 C LYS A 70 9.852 -3.331 10.707 1.00 1.01 C ATOM 1154 O LYS A 70 9.037 -4.249 10.865 1.00 32.54 O ATOM 1155 CB LYS A 70 11.840 -4.654 9.781 1.00 3.31 C ATOM 1156 CG LYS A 70 12.825 -4.916 8.608 1.00 31.24 C ATOM 1157 CD LYS A 70 13.623 -6.237 8.771 1.00 72.12 C ATOM 1158 CE LYS A 70 14.515 -6.258 10.028 1.00 34.23 C ATOM 1159 NZ LYS A 70 15.550 -5.196 10.004 1.00 43.00 N ATOM 0 H LYS A 70 12.721 -2.332 9.822 1.00 30.53 H new ATOM 0 HA LYS A 70 10.365 -3.510 8.660 1.00 23.42 H new ATOM 0 HB2 LYS A 70 12.414 -4.528 10.699 1.00 3.31 H new ATOM 0 HB3 LYS A 70 11.213 -5.535 9.916 1.00 3.31 H new ATOM 0 HG2 LYS A 70 12.267 -4.948 7.672 1.00 31.24 H new ATOM 0 HG3 LYS A 70 13.524 -4.083 8.534 1.00 31.24 H new ATOM 0 HD2 LYS A 70 12.924 -7.073 8.815 1.00 72.12 H new ATOM 0 HD3 LYS A 70 14.246 -6.389 7.889 1.00 72.12 H new ATOM 0 HE2 LYS A 70 13.892 -6.135 10.914 1.00 34.23 H new ATOM 0 HE3 LYS A 70 14.999 -7.231 10.111 1.00 34.23 H new ATOM 0 HZ1 LYS A 70 16.166 -5.293 10.836 1.00 43.00 H new ATOM 0 HZ2 LYS A 70 16.120 -5.286 9.139 1.00 43.00 H new ATOM 0 HZ3 LYS A 70 15.091 -4.263 10.021 1.00 43.00 H new ATOM 1173 N LYS A 71 9.848 -2.225 11.465 1.00 24.33 N ATOM 1174 CA LYS A 71 8.785 -1.925 12.449 1.00 23.30 C ATOM 1175 C LYS A 71 7.502 -1.385 11.757 1.00 22.22 C ATOM 1176 O LYS A 71 6.476 -1.206 12.410 1.00 2.11 O ATOM 1177 CB LYS A 71 9.297 -0.899 13.493 1.00 55.11 C ATOM 1178 CG LYS A 71 9.558 0.516 12.925 1.00 4.14 C ATOM 1179 CD LYS A 71 10.075 1.541 13.964 1.00 5.44 C ATOM 1180 CE LYS A 71 11.555 1.345 14.350 1.00 4.14 C ATOM 1181 NZ LYS A 71 11.811 0.084 15.103 1.00 74.02 N ATOM 0 H LYS A 71 10.576 -1.513 11.418 1.00 24.33 H new ATOM 0 HA LYS A 71 8.527 -2.856 12.954 1.00 23.30 H new ATOM 0 HB2 LYS A 71 8.567 -0.825 14.299 1.00 55.11 H new ATOM 0 HB3 LYS A 71 10.220 -1.277 13.933 1.00 55.11 H new ATOM 0 HG2 LYS A 71 10.284 0.440 12.116 1.00 4.14 H new ATOM 0 HG3 LYS A 71 8.634 0.895 12.489 1.00 4.14 H new ATOM 0 HD2 LYS A 71 9.944 2.547 13.565 1.00 5.44 H new ATOM 0 HD3 LYS A 71 9.463 1.473 14.863 1.00 5.44 H new ATOM 0 HE2 LYS A 71 12.162 1.348 13.445 1.00 4.14 H new ATOM 0 HE3 LYS A 71 11.880 2.192 14.954 1.00 4.14 H new ATOM 0 HZ1 LYS A 71 12.572 0.241 15.794 1.00 74.02 H new ATOM 0 HZ2 LYS A 71 10.945 -0.205 15.601 1.00 74.02 H new ATOM 0 HZ3 LYS A 71 12.095 -0.665 14.440 1.00 74.02 H new ATOM 1195 N TYR A 72 7.597 -1.088 10.442 1.00 12.43 N ATOM 1196 CA TYR A 72 6.452 -0.636 9.607 1.00 32.22 C ATOM 1197 C TYR A 72 5.836 -1.786 8.766 1.00 2.53 C ATOM 1198 O TYR A 72 5.016 -1.532 7.872 1.00 52.32 O ATOM 1199 CB TYR A 72 6.895 0.536 8.697 1.00 31.43 C ATOM 1200 CG TYR A 72 7.171 1.843 9.463 1.00 14.11 C ATOM 1201 CD1 TYR A 72 8.410 2.092 10.060 1.00 25.52 C ATOM 1202 CD2 TYR A 72 6.188 2.822 9.601 1.00 34.55 C ATOM 1203 CE1 TYR A 72 8.657 3.265 10.759 1.00 10.24 C ATOM 1204 CE2 TYR A 72 6.432 3.990 10.299 1.00 64.24 C ATOM 1205 CZ TYR A 72 7.665 4.208 10.874 1.00 75.11 C ATOM 1206 OH TYR A 72 7.907 5.379 11.563 1.00 63.10 O ATOM 0 H TYR A 72 8.473 -1.154 9.924 1.00 12.43 H new ATOM 0 HA TYR A 72 5.668 -0.294 10.283 1.00 32.22 H new ATOM 0 HB2 TYR A 72 7.796 0.245 8.157 1.00 31.43 H new ATOM 0 HB3 TYR A 72 6.121 0.718 7.952 1.00 31.43 H new ATOM 0 HD1 TYR A 72 9.194 1.354 9.975 1.00 25.52 H new ATOM 0 HD2 TYR A 72 5.217 2.665 9.154 1.00 34.55 H new ATOM 0 HE1 TYR A 72 9.623 3.435 11.210 1.00 10.24 H new ATOM 0 HE2 TYR A 72 5.654 4.733 10.394 1.00 64.24 H new ATOM 0 HH TYR A 72 7.093 5.657 12.032 1.00 63.10 H new ATOM 1216 N HIS A 73 6.229 -3.044 9.068 1.00 55.12 N ATOM 1217 CA HIS A 73 5.676 -4.261 8.410 1.00 74.00 C ATOM 1218 C HIS A 73 4.132 -4.346 8.469 1.00 24.21 C ATOM 1219 O HIS A 73 3.517 -4.929 7.590 1.00 42.31 O ATOM 1220 CB HIS A 73 6.252 -5.558 9.051 1.00 1.10 C ATOM 1221 CG HIS A 73 7.626 -5.964 8.605 1.00 74.54 C ATOM 1222 ND1 HIS A 73 8.378 -6.887 9.296 1.00 71.25 N ATOM 1223 CD2 HIS A 73 8.353 -5.642 7.508 1.00 22.34 C ATOM 1224 CE1 HIS A 73 9.494 -7.114 8.650 1.00 70.55 C ATOM 1225 NE2 HIS A 73 9.507 -6.376 7.561 1.00 15.00 N ATOM 0 H HIS A 73 6.937 -3.250 9.773 1.00 55.12 H new ATOM 0 HA HIS A 73 5.977 -4.178 7.366 1.00 74.00 H new ATOM 0 HB2 HIS A 73 6.268 -5.427 10.133 1.00 1.10 H new ATOM 0 HB3 HIS A 73 5.567 -6.379 8.839 1.00 1.10 H new ATOM 0 HD2 HIS A 73 8.074 -4.939 6.737 1.00 22.34 H new ATOM 0 HE1 HIS A 73 10.274 -7.794 8.960 1.00 70.55 H new ATOM 0 HE2 HIS A 73 10.256 -6.354 6.869 1.00 15.00 H new ATOM 1234 N ASN A 74 3.525 -3.846 9.544 1.00 41.13 N ATOM 1235 CA ASN A 74 2.056 -3.938 9.743 1.00 44.21 C ATOM 1236 C ASN A 74 1.384 -2.555 9.857 1.00 12.55 C ATOM 1237 O ASN A 74 0.178 -2.471 10.101 1.00 42.31 O ATOM 1238 CB ASN A 74 1.798 -4.759 11.027 1.00 33.33 C ATOM 1239 CG ASN A 74 2.594 -6.067 11.058 1.00 72.02 C ATOM 1240 OD1 ASN A 74 3.662 -6.147 11.656 1.00 14.05 O ATOM 1241 ND2 ASN A 74 2.115 -7.070 10.358 1.00 74.14 N ATOM 0 H ASN A 74 4.018 -3.370 10.299 1.00 41.13 H new ATOM 0 HA ASN A 74 1.618 -4.423 8.870 1.00 44.21 H new ATOM 0 HB2 ASN A 74 2.060 -4.158 11.897 1.00 33.33 H new ATOM 0 HB3 ASN A 74 0.734 -4.983 11.103 1.00 33.33 H new ATOM 0 HD21 ASN A 74 2.634 -7.946 10.301 1.00 74.14 H new ATOM 0 HD22 ASN A 74 1.224 -6.973 9.872 1.00 74.14 H new ATOM 1248 N ASP A 75 2.166 -1.483 9.662 1.00 11.21 N ATOM 1249 CA ASP A 75 1.757 -0.116 10.045 1.00 22.42 C ATOM 1250 C ASP A 75 0.643 0.464 9.123 1.00 72.34 C ATOM 1251 O ASP A 75 0.894 0.698 7.942 1.00 44.32 O ATOM 1252 CB ASP A 75 2.988 0.812 10.060 1.00 73.00 C ATOM 1253 CG ASP A 75 2.653 2.197 10.615 1.00 14.43 C ATOM 1254 OD1 ASP A 75 2.436 2.313 11.839 1.00 65.14 O ATOM 1255 OD2 ASP A 75 2.590 3.162 9.839 1.00 4.01 O ATOM 0 H ASP A 75 3.093 -1.534 9.238 1.00 11.21 H new ATOM 0 HA ASP A 75 1.328 -0.174 11.046 1.00 22.42 H new ATOM 0 HB2 ASP A 75 3.776 0.360 10.663 1.00 73.00 H new ATOM 0 HB3 ASP A 75 3.379 0.912 9.048 1.00 73.00 H new ATOM 1260 N PRO A 76 -0.592 0.749 9.669 1.00 40.23 N ATOM 1261 CA PRO A 76 -1.726 1.274 8.860 1.00 14.40 C ATOM 1262 C PRO A 76 -1.432 2.626 8.157 1.00 62.11 C ATOM 1263 O PRO A 76 -1.906 2.848 7.042 1.00 42.14 O ATOM 1264 CB PRO A 76 -2.885 1.403 9.890 1.00 5.03 C ATOM 1265 CG PRO A 76 -2.217 1.432 11.231 1.00 40.13 C ATOM 1266 CD PRO A 76 -0.989 0.561 11.093 1.00 43.22 C ATOM 0 HA PRO A 76 -1.954 0.609 8.027 1.00 14.40 H new ATOM 0 HB2 PRO A 76 -3.465 2.310 9.719 1.00 5.03 H new ATOM 0 HB3 PRO A 76 -3.576 0.564 9.812 1.00 5.03 H new ATOM 0 HG2 PRO A 76 -1.946 2.450 11.512 1.00 40.13 H new ATOM 0 HG3 PRO A 76 -2.881 1.053 12.008 1.00 40.13 H new ATOM 0 HD2 PRO A 76 -0.198 0.871 11.775 1.00 43.22 H new ATOM 0 HD3 PRO A 76 -1.210 -0.483 11.314 1.00 43.22 H new ATOM 1274 N ARG A 77 -0.645 3.511 8.813 1.00 34.21 N ATOM 1275 CA ARG A 77 -0.266 4.834 8.256 1.00 34.03 C ATOM 1276 C ARG A 77 0.629 4.685 6.984 1.00 10.24 C ATOM 1277 O ARG A 77 0.427 5.386 5.984 1.00 23.53 O ATOM 1278 CB ARG A 77 0.490 5.670 9.329 1.00 21.31 C ATOM 1279 CG ARG A 77 -0.309 6.047 10.600 1.00 62.30 C ATOM 1280 CD ARG A 77 0.596 6.661 11.699 1.00 12.52 C ATOM 1281 NE ARG A 77 1.384 7.821 11.224 1.00 21.23 N ATOM 1282 CZ ARG A 77 2.528 8.244 11.752 1.00 40.22 C ATOM 1283 NH1 ARG A 77 3.082 7.634 12.748 1.00 74.20 N ATOM 1284 NH2 ARG A 77 3.120 9.271 11.272 1.00 63.21 N ATOM 0 H ARG A 77 -0.256 3.331 9.739 1.00 34.21 H new ATOM 0 HA ARG A 77 -1.184 5.347 7.970 1.00 34.03 H new ATOM 0 HB2 ARG A 77 1.375 5.112 9.635 1.00 21.31 H new ATOM 0 HB3 ARG A 77 0.840 6.590 8.861 1.00 21.31 H new ATOM 0 HG2 ARG A 77 -1.092 6.758 10.337 1.00 62.30 H new ATOM 0 HG3 ARG A 77 -0.804 5.159 10.993 1.00 62.30 H new ATOM 0 HD2 ARG A 77 -0.024 6.971 12.540 1.00 12.52 H new ATOM 0 HD3 ARG A 77 1.277 5.895 12.070 1.00 12.52 H new ATOM 0 HE ARG A 77 1.018 8.339 10.425 1.00 21.23 H new ATOM 0 HH11 ARG A 77 2.641 6.806 13.148 1.00 74.20 H new ATOM 0 HH12 ARG A 77 3.960 7.981 13.134 1.00 74.20 H new ATOM 0 HH21 ARG A 77 2.714 9.770 10.480 1.00 63.21 H new ATOM 0 HH22 ARG A 77 3.998 9.591 11.681 1.00 63.21 H new ATOM 1298 N PHE A 78 1.614 3.764 7.056 1.00 21.21 N ATOM 1299 CA PHE A 78 2.555 3.475 5.950 1.00 31.54 C ATOM 1300 C PHE A 78 1.844 2.736 4.786 1.00 40.42 C ATOM 1301 O PHE A 78 1.973 3.133 3.620 1.00 14.23 O ATOM 1302 CB PHE A 78 3.761 2.642 6.482 1.00 30.05 C ATOM 1303 CG PHE A 78 4.704 2.122 5.392 1.00 61.23 C ATOM 1304 CD1 PHE A 78 5.275 2.998 4.465 1.00 25.23 C ATOM 1305 CD2 PHE A 78 4.986 0.758 5.268 1.00 31.41 C ATOM 1306 CE1 PHE A 78 6.095 2.527 3.460 1.00 54.14 C ATOM 1307 CE2 PHE A 78 5.805 0.292 4.259 1.00 73.51 C ATOM 1308 CZ PHE A 78 6.358 1.173 3.357 1.00 55.22 C ATOM 0 H PHE A 78 1.780 3.197 7.887 1.00 21.21 H new ATOM 0 HA PHE A 78 2.927 4.422 5.558 1.00 31.54 H new ATOM 0 HB2 PHE A 78 4.333 3.257 7.176 1.00 30.05 H new ATOM 0 HB3 PHE A 78 3.378 1.793 7.049 1.00 30.05 H new ATOM 0 HD1 PHE A 78 5.072 4.056 4.536 1.00 25.23 H new ATOM 0 HD2 PHE A 78 4.557 0.059 5.971 1.00 31.41 H new ATOM 0 HE1 PHE A 78 6.532 3.217 2.753 1.00 54.14 H new ATOM 0 HE2 PHE A 78 6.012 -0.765 4.177 1.00 73.51 H new ATOM 0 HZ PHE A 78 6.998 0.806 2.568 1.00 55.22 H new ATOM 1318 N ILE A 79 1.106 1.655 5.126 1.00 24.23 N ATOM 1319 CA ILE A 79 0.317 0.862 4.150 1.00 60.21 C ATOM 1320 C ILE A 79 -0.723 1.752 3.421 1.00 24.35 C ATOM 1321 O ILE A 79 -0.945 1.570 2.227 1.00 35.12 O ATOM 1322 CB ILE A 79 -0.377 -0.404 4.832 1.00 24.42 C ATOM 1323 CG1 ILE A 79 0.626 -1.603 4.968 1.00 3.04 C ATOM 1324 CG2 ILE A 79 -1.663 -0.879 4.078 1.00 32.42 C ATOM 1325 CD1 ILE A 79 1.849 -1.384 5.853 1.00 25.45 C ATOM 0 H ILE A 79 1.039 1.307 6.082 1.00 24.23 H new ATOM 0 HA ILE A 79 1.014 0.479 3.404 1.00 60.21 H new ATOM 0 HB ILE A 79 -0.681 -0.072 5.825 1.00 24.42 H new ATOM 0 HG12 ILE A 79 0.077 -2.462 5.354 1.00 3.04 H new ATOM 0 HG13 ILE A 79 0.973 -1.869 3.970 1.00 3.04 H new ATOM 0 HG21 ILE A 79 -2.088 -1.742 4.591 1.00 32.42 H new ATOM 0 HG22 ILE A 79 -2.394 -0.071 4.061 1.00 32.42 H new ATOM 0 HG23 ILE A 79 -1.404 -1.155 3.056 1.00 32.42 H new ATOM 0 HD11 ILE A 79 2.459 -2.287 5.861 1.00 25.45 H new ATOM 0 HD12 ILE A 79 2.437 -0.553 5.463 1.00 25.45 H new ATOM 0 HD13 ILE A 79 1.527 -1.155 6.869 1.00 25.45 H new ATOM 1337 N SER A 80 -1.314 2.727 4.142 1.00 75.51 N ATOM 1338 CA SER A 80 -2.255 3.721 3.559 1.00 74.31 C ATOM 1339 C SER A 80 -1.630 4.488 2.370 1.00 44.52 C ATOM 1340 O SER A 80 -2.307 4.766 1.376 1.00 62.10 O ATOM 1341 CB SER A 80 -2.696 4.728 4.643 1.00 53.30 C ATOM 1342 OG SER A 80 -3.515 5.756 4.108 1.00 63.02 O ATOM 0 H SER A 80 -1.157 2.852 5.142 1.00 75.51 H new ATOM 0 HA SER A 80 -3.118 3.170 3.185 1.00 74.31 H new ATOM 0 HB2 SER A 80 -3.240 4.202 5.428 1.00 53.30 H new ATOM 0 HB3 SER A 80 -1.815 5.171 5.108 1.00 53.30 H new ATOM 0 HG SER A 80 -3.775 6.373 4.824 1.00 63.02 H new ATOM 1348 N TYR A 81 -0.334 4.820 2.488 1.00 62.15 N ATOM 1349 CA TYR A 81 0.416 5.515 1.417 1.00 74.25 C ATOM 1350 C TYR A 81 0.878 4.563 0.291 1.00 63.25 C ATOM 1351 O TYR A 81 1.117 5.015 -0.829 1.00 4.00 O ATOM 1352 CB TYR A 81 1.621 6.268 1.990 1.00 4.13 C ATOM 1353 CG TYR A 81 1.268 7.489 2.836 1.00 43.22 C ATOM 1354 CD1 TYR A 81 0.436 8.493 2.334 1.00 22.43 C ATOM 1355 CD2 TYR A 81 1.775 7.647 4.126 1.00 53.30 C ATOM 1356 CE1 TYR A 81 0.122 9.599 3.094 1.00 0.42 C ATOM 1357 CE2 TYR A 81 1.463 8.750 4.880 1.00 73.34 C ATOM 1358 CZ TYR A 81 0.635 9.725 4.362 1.00 40.42 C ATOM 1359 OH TYR A 81 0.309 10.830 5.116 1.00 50.04 O ATOM 0 H TYR A 81 0.223 4.619 3.318 1.00 62.15 H new ATOM 0 HA TYR A 81 -0.279 6.228 0.974 1.00 74.25 H new ATOM 0 HB2 TYR A 81 2.207 5.579 2.598 1.00 4.13 H new ATOM 0 HB3 TYR A 81 2.259 6.587 1.165 1.00 4.13 H new ATOM 0 HD1 TYR A 81 0.033 8.401 1.336 1.00 22.43 H new ATOM 0 HD2 TYR A 81 2.424 6.888 4.538 1.00 53.30 H new ATOM 0 HE1 TYR A 81 -0.526 10.365 2.694 1.00 0.42 H new ATOM 0 HE2 TYR A 81 1.865 8.855 5.877 1.00 73.34 H new ATOM 0 HH TYR A 81 0.003 10.543 6.002 1.00 50.04 H new ATOM 1369 N CYS A 82 1.059 3.269 0.606 1.00 62.55 N ATOM 1370 CA CYS A 82 1.254 2.223 -0.428 1.00 65.11 C ATOM 1371 C CYS A 82 -0.044 2.027 -1.256 1.00 2.01 C ATOM 1372 O CYS A 82 0.007 1.748 -2.452 1.00 34.04 O ATOM 1373 CB CYS A 82 1.696 0.890 0.215 1.00 3.11 C ATOM 1374 SG CYS A 82 3.276 0.983 1.090 1.00 60.14 S ATOM 0 H CYS A 82 1.075 2.917 1.563 1.00 62.55 H new ATOM 0 HA CYS A 82 2.045 2.553 -1.101 1.00 65.11 H new ATOM 0 HB2 CYS A 82 0.925 0.562 0.912 1.00 3.11 H new ATOM 0 HB3 CYS A 82 1.767 0.130 -0.563 1.00 3.11 H new ATOM 0 HG CYS A 82 3.143 1.726 2.148 1.00 60.14 H new ATOM 1380 N LEU A 83 -1.207 2.193 -0.585 1.00 15.34 N ATOM 1381 CA LEU A 83 -2.544 2.174 -1.228 1.00 62.20 C ATOM 1382 C LEU A 83 -2.758 3.452 -2.083 1.00 64.15 C ATOM 1383 O LEU A 83 -3.305 3.389 -3.184 1.00 52.30 O ATOM 1384 CB LEU A 83 -3.663 2.049 -0.156 1.00 14.35 C ATOM 1385 CG LEU A 83 -3.619 0.776 0.748 1.00 75.03 C ATOM 1386 CD1 LEU A 83 -4.745 0.798 1.802 1.00 12.32 C ATOM 1387 CD2 LEU A 83 -3.657 -0.522 -0.091 1.00 65.40 C ATOM 0 H LEU A 83 -1.246 2.345 0.423 1.00 15.34 H new ATOM 0 HA LEU A 83 -2.594 1.306 -1.885 1.00 62.20 H new ATOM 0 HB2 LEU A 83 -3.619 2.927 0.488 1.00 14.35 H new ATOM 0 HB3 LEU A 83 -4.627 2.074 -0.664 1.00 14.35 H new ATOM 0 HG LEU A 83 -2.668 0.789 1.280 1.00 75.03 H new ATOM 0 HD11 LEU A 83 -4.687 -0.101 2.415 1.00 12.32 H new ATOM 0 HD12 LEU A 83 -4.633 1.677 2.436 1.00 12.32 H new ATOM 0 HD13 LEU A 83 -5.712 0.834 1.301 1.00 12.32 H new ATOM 0 HD21 LEU A 83 -3.625 -1.386 0.573 1.00 65.40 H new ATOM 0 HD22 LEU A 83 -4.575 -0.549 -0.677 1.00 65.40 H new ATOM 0 HD23 LEU A 83 -2.798 -0.547 -0.761 1.00 65.40 H new ATOM 1399 N LYS A 84 -2.312 4.606 -1.549 1.00 64.02 N ATOM 1400 CA LYS A 84 -2.269 5.896 -2.273 1.00 51.11 C ATOM 1401 C LYS A 84 -1.409 5.771 -3.552 1.00 33.53 C ATOM 1402 O LYS A 84 -1.817 6.188 -4.620 1.00 3.44 O ATOM 1403 CB LYS A 84 -1.696 6.991 -1.303 1.00 24.14 C ATOM 1404 CG LYS A 84 -0.933 8.163 -1.955 1.00 74.12 C ATOM 1405 CD LYS A 84 -1.838 9.210 -2.639 1.00 63.12 C ATOM 1406 CE LYS A 84 -2.420 10.223 -1.644 1.00 32.41 C ATOM 1407 NZ LYS A 84 -3.319 11.205 -2.302 1.00 41.22 N ATOM 0 H LYS A 84 -1.967 4.671 -0.591 1.00 64.02 H new ATOM 0 HA LYS A 84 -3.272 6.183 -2.587 1.00 51.11 H new ATOM 0 HB2 LYS A 84 -2.525 7.403 -0.727 1.00 24.14 H new ATOM 0 HB3 LYS A 84 -1.028 6.502 -0.594 1.00 24.14 H new ATOM 0 HG2 LYS A 84 -0.335 8.661 -1.192 1.00 74.12 H new ATOM 0 HG3 LYS A 84 -0.239 7.763 -2.694 1.00 74.12 H new ATOM 0 HD2 LYS A 84 -1.264 9.740 -3.399 1.00 63.12 H new ATOM 0 HD3 LYS A 84 -2.653 8.701 -3.153 1.00 63.12 H new ATOM 0 HE2 LYS A 84 -2.971 9.692 -0.868 1.00 32.41 H new ATOM 0 HE3 LYS A 84 -1.606 10.753 -1.150 1.00 32.41 H new ATOM 0 HZ1 LYS A 84 -4.116 11.424 -1.670 1.00 41.22 H new ATOM 0 HZ2 LYS A 84 -2.790 12.077 -2.507 1.00 41.22 H new ATOM 0 HZ3 LYS A 84 -3.681 10.803 -3.190 1.00 41.22 H new ATOM 1421 N PHE A 85 -0.224 5.179 -3.403 1.00 11.22 N ATOM 1422 CA PHE A 85 0.730 4.971 -4.505 1.00 65.22 C ATOM 1423 C PHE A 85 0.215 3.924 -5.521 1.00 11.43 C ATOM 1424 O PHE A 85 0.480 4.042 -6.720 1.00 4.13 O ATOM 1425 CB PHE A 85 2.099 4.580 -3.895 1.00 65.01 C ATOM 1426 CG PHE A 85 3.220 4.247 -4.873 1.00 14.24 C ATOM 1427 CD1 PHE A 85 3.455 5.030 -6.002 1.00 40.45 C ATOM 1428 CD2 PHE A 85 4.052 3.157 -4.651 1.00 22.05 C ATOM 1429 CE1 PHE A 85 4.483 4.714 -6.869 1.00 64.22 C ATOM 1430 CE2 PHE A 85 5.076 2.847 -5.518 1.00 64.10 C ATOM 1431 CZ PHE A 85 5.290 3.624 -6.626 1.00 22.11 C ATOM 0 H PHE A 85 0.109 4.825 -2.506 1.00 11.22 H new ATOM 0 HA PHE A 85 0.844 5.894 -5.074 1.00 65.22 H new ATOM 0 HB2 PHE A 85 2.435 5.401 -3.261 1.00 65.01 H new ATOM 0 HB3 PHE A 85 1.947 3.717 -3.246 1.00 65.01 H new ATOM 0 HD1 PHE A 85 2.830 5.888 -6.200 1.00 40.45 H new ATOM 0 HD2 PHE A 85 3.892 2.539 -3.780 1.00 22.05 H new ATOM 0 HE1 PHE A 85 4.655 5.325 -7.743 1.00 64.22 H new ATOM 0 HE2 PHE A 85 5.709 1.993 -5.325 1.00 64.10 H new ATOM 0 HZ PHE A 85 6.091 3.382 -7.309 1.00 22.11 H new ATOM 1441 N ALA A 86 -0.559 2.944 -5.019 1.00 34.13 N ATOM 1442 CA ALA A 86 -1.102 1.828 -5.817 1.00 33.45 C ATOM 1443 C ALA A 86 -1.855 2.293 -7.078 1.00 71.44 C ATOM 1444 O ALA A 86 -1.515 1.883 -8.178 1.00 42.33 O ATOM 1445 CB ALA A 86 -2.018 0.967 -4.950 1.00 54.53 C ATOM 0 H ALA A 86 -0.828 2.904 -4.036 1.00 34.13 H new ATOM 0 HA ALA A 86 -0.249 1.243 -6.160 1.00 33.45 H new ATOM 0 HB1 ALA A 86 -2.415 0.145 -5.545 1.00 54.53 H new ATOM 0 HB2 ALA A 86 -1.452 0.566 -4.109 1.00 54.53 H new ATOM 0 HB3 ALA A 86 -2.842 1.575 -4.575 1.00 54.53 H new ATOM 1451 N GLU A 87 -2.835 3.196 -6.907 1.00 10.32 N ATOM 1452 CA GLU A 87 -3.680 3.714 -8.020 1.00 32.55 C ATOM 1453 C GLU A 87 -2.850 4.333 -9.188 1.00 42.42 C ATOM 1454 O GLU A 87 -3.337 4.444 -10.314 1.00 33.44 O ATOM 1455 CB GLU A 87 -4.674 4.756 -7.456 1.00 25.52 C ATOM 1456 CG GLU A 87 -3.989 5.967 -6.800 1.00 61.24 C ATOM 1457 CD GLU A 87 -4.963 6.964 -6.160 1.00 25.31 C ATOM 1458 OE1 GLU A 87 -5.489 7.837 -6.880 1.00 13.10 O ATOM 1459 OE2 GLU A 87 -5.203 6.879 -4.936 1.00 1.50 O ATOM 0 H GLU A 87 -3.071 3.593 -5.998 1.00 10.32 H new ATOM 0 HA GLU A 87 -4.215 2.866 -8.446 1.00 32.55 H new ATOM 0 HB2 GLU A 87 -5.318 5.106 -8.263 1.00 25.52 H new ATOM 0 HB3 GLU A 87 -5.318 4.272 -6.722 1.00 25.52 H new ATOM 0 HG2 GLU A 87 -3.297 5.611 -6.037 1.00 61.24 H new ATOM 0 HG3 GLU A 87 -3.395 6.487 -7.552 1.00 61.24 H new ATOM 1466 N TYR A 88 -1.597 4.722 -8.892 1.00 3.33 N ATOM 1467 CA TYR A 88 -0.659 5.296 -9.885 1.00 73.00 C ATOM 1468 C TYR A 88 0.148 4.192 -10.633 1.00 40.10 C ATOM 1469 O TYR A 88 0.627 4.415 -11.748 1.00 65.10 O ATOM 1470 CB TYR A 88 0.297 6.291 -9.177 1.00 21.50 C ATOM 1471 CG TYR A 88 -0.433 7.360 -8.331 1.00 11.43 C ATOM 1472 CD1 TYR A 88 -1.487 8.111 -8.867 1.00 1.21 C ATOM 1473 CD2 TYR A 88 -0.089 7.601 -6.995 1.00 24.34 C ATOM 1474 CE1 TYR A 88 -2.158 9.052 -8.104 1.00 52.41 C ATOM 1475 CE2 TYR A 88 -0.762 8.537 -6.237 1.00 45.01 C ATOM 1476 CZ TYR A 88 -1.793 9.256 -6.792 1.00 42.13 C ATOM 1477 OH TYR A 88 -2.477 10.171 -6.023 1.00 13.03 O ATOM 0 H TYR A 88 -1.201 4.649 -7.955 1.00 3.33 H new ATOM 0 HA TYR A 88 -1.243 5.825 -10.638 1.00 73.00 H new ATOM 0 HB2 TYR A 88 0.976 5.733 -8.533 1.00 21.50 H new ATOM 0 HB3 TYR A 88 0.909 6.791 -9.928 1.00 21.50 H new ATOM 0 HD1 TYR A 88 -1.782 7.953 -9.894 1.00 1.21 H new ATOM 0 HD2 TYR A 88 0.720 7.042 -6.549 1.00 24.34 H new ATOM 0 HE1 TYR A 88 -2.965 9.624 -8.537 1.00 52.41 H new ATOM 0 HE2 TYR A 88 -0.479 8.704 -5.208 1.00 45.01 H new ATOM 0 HH TYR A 88 -2.738 9.755 -5.175 1.00 13.03 H new ATOM 1487 N ASN A 89 0.300 3.015 -9.994 1.00 61.10 N ATOM 1488 CA ASN A 89 0.920 1.807 -10.608 1.00 33.23 C ATOM 1489 C ASN A 89 -0.106 1.042 -11.475 1.00 44.13 C ATOM 1490 O ASN A 89 -1.282 0.932 -11.104 1.00 3.24 O ATOM 1491 CB ASN A 89 1.472 0.855 -9.517 1.00 41.33 C ATOM 1492 CG ASN A 89 2.595 1.476 -8.699 1.00 51.21 C ATOM 1493 OD1 ASN A 89 3.766 1.338 -9.015 1.00 30.00 O ATOM 1494 ND2 ASN A 89 2.246 2.179 -7.654 1.00 72.54 N ATOM 0 H ASN A 89 -0.003 2.867 -9.031 1.00 61.10 H new ATOM 0 HA ASN A 89 1.742 2.146 -11.239 1.00 33.23 H new ATOM 0 HB2 ASN A 89 0.660 0.567 -8.849 1.00 41.33 H new ATOM 0 HB3 ASN A 89 1.836 -0.058 -9.989 1.00 41.33 H new ATOM 0 HD21 ASN A 89 2.960 2.628 -7.080 1.00 72.54 H new ATOM 0 HD22 ASN A 89 1.260 2.278 -7.412 1.00 72.54 H new ATOM 1501 N SER A 90 0.357 0.505 -12.621 1.00 71.42 N ATOM 1502 CA SER A 90 -0.498 -0.265 -13.557 1.00 50.51 C ATOM 1503 C SER A 90 -0.798 -1.684 -13.009 1.00 74.52 C ATOM 1504 O SER A 90 -1.952 -2.006 -12.675 1.00 53.50 O ATOM 1505 CB SER A 90 0.176 -0.362 -14.953 1.00 43.22 C ATOM 1506 OG SER A 90 0.434 0.920 -15.508 1.00 65.11 O ATOM 0 H SER A 90 1.327 0.590 -12.926 1.00 71.42 H new ATOM 0 HA SER A 90 -1.445 0.266 -13.656 1.00 50.51 H new ATOM 0 HB2 SER A 90 1.111 -0.915 -14.867 1.00 43.22 H new ATOM 0 HB3 SER A 90 -0.467 -0.927 -15.628 1.00 43.22 H new ATOM 0 HG SER A 90 0.860 0.817 -16.385 1.00 65.11 H new ATOM 1512 N ASP A 91 0.252 -2.524 -12.910 1.00 24.11 N ATOM 1513 CA ASP A 91 0.118 -3.927 -12.472 1.00 74.41 C ATOM 1514 C ASP A 91 0.092 -4.010 -10.926 1.00 12.01 C ATOM 1515 O ASP A 91 1.136 -4.129 -10.259 1.00 52.31 O ATOM 1516 CB ASP A 91 1.260 -4.806 -13.070 1.00 54.24 C ATOM 1517 CG ASP A 91 0.955 -6.316 -13.033 1.00 60.45 C ATOM 1518 OD1 ASP A 91 0.554 -6.819 -11.966 1.00 31.45 O ATOM 1519 OD2 ASP A 91 1.087 -7.002 -14.074 1.00 12.25 O ATOM 0 H ASP A 91 1.210 -2.251 -13.130 1.00 24.11 H new ATOM 0 HA ASP A 91 -0.828 -4.319 -12.846 1.00 74.41 H new ATOM 0 HB2 ASP A 91 1.438 -4.504 -14.102 1.00 54.24 H new ATOM 0 HB3 ASP A 91 2.181 -4.616 -12.519 1.00 54.24 H new ATOM 1524 N LEU A 92 -1.124 -3.941 -10.375 1.00 14.01 N ATOM 1525 CA LEU A 92 -1.359 -4.048 -8.925 1.00 1.31 C ATOM 1526 C LEU A 92 -1.209 -5.483 -8.396 1.00 65.21 C ATOM 1527 O LEU A 92 -1.068 -5.669 -7.181 1.00 3.31 O ATOM 1528 CB LEU A 92 -2.739 -3.469 -8.561 1.00 22.34 C ATOM 1529 CG LEU A 92 -2.925 -1.958 -8.861 1.00 51.45 C ATOM 1530 CD1 LEU A 92 -4.323 -1.445 -8.438 1.00 53.13 C ATOM 1531 CD2 LEU A 92 -1.797 -1.149 -8.209 1.00 0.10 C ATOM 0 H LEU A 92 -1.976 -3.809 -10.919 1.00 14.01 H new ATOM 0 HA LEU A 92 -0.584 -3.459 -8.435 1.00 1.31 H new ATOM 0 HB2 LEU A 92 -3.503 -4.027 -9.103 1.00 22.34 H new ATOM 0 HB3 LEU A 92 -2.916 -3.636 -7.498 1.00 22.34 H new ATOM 0 HG LEU A 92 -2.867 -1.819 -9.941 1.00 51.45 H new ATOM 0 HD11 LEU A 92 -4.406 -0.383 -8.668 1.00 53.13 H new ATOM 0 HD12 LEU A 92 -5.092 -1.995 -8.981 1.00 53.13 H new ATOM 0 HD13 LEU A 92 -4.457 -1.596 -7.367 1.00 53.13 H new ATOM 0 HD21 LEU A 92 -1.937 -0.090 -8.426 1.00 0.10 H new ATOM 0 HD22 LEU A 92 -1.815 -1.304 -7.130 1.00 0.10 H new ATOM 0 HD23 LEU A 92 -0.837 -1.477 -8.607 1.00 0.10 H new ATOM 1543 N HIS A 93 -1.205 -6.495 -9.294 1.00 51.13 N ATOM 1544 CA HIS A 93 -1.035 -7.895 -8.861 1.00 70.12 C ATOM 1545 C HIS A 93 0.417 -8.065 -8.364 1.00 52.02 C ATOM 1546 O HIS A 93 0.636 -8.504 -7.248 1.00 61.40 O ATOM 1547 CB HIS A 93 -1.470 -8.925 -9.981 1.00 22.20 C ATOM 1548 CG HIS A 93 -0.411 -9.704 -10.751 1.00 52.20 C ATOM 1549 ND1 HIS A 93 -0.122 -9.480 -12.079 1.00 53.52 N ATOM 1550 CD2 HIS A 93 0.349 -10.774 -10.400 1.00 64.32 C ATOM 1551 CE1 HIS A 93 0.747 -10.365 -12.503 1.00 71.33 C ATOM 1552 NE2 HIS A 93 1.051 -11.159 -11.505 1.00 51.14 N ATOM 0 H HIS A 93 -1.315 -6.370 -10.300 1.00 51.13 H new ATOM 0 HA HIS A 93 -1.706 -8.124 -8.033 1.00 70.12 H new ATOM 0 HB2 HIS A 93 -2.132 -9.653 -9.512 1.00 22.20 H new ATOM 0 HB3 HIS A 93 -2.065 -8.377 -10.712 1.00 22.20 H new ATOM 0 HD1 HIS A 93 -0.525 -8.736 -12.648 1.00 53.52 H new ATOM 0 HD2 HIS A 93 0.390 -11.236 -9.424 1.00 64.32 H new ATOM 0 HE1 HIS A 93 1.145 -10.429 -13.505 1.00 71.33 H new ATOM 1561 N GLN A 94 1.384 -7.603 -9.175 1.00 21.14 N ATOM 1562 CA GLN A 94 2.823 -7.642 -8.838 1.00 64.24 C ATOM 1563 C GLN A 94 3.211 -6.545 -7.815 1.00 63.34 C ATOM 1564 O GLN A 94 4.150 -6.735 -7.033 1.00 53.53 O ATOM 1565 CB GLN A 94 3.666 -7.522 -10.135 1.00 75.53 C ATOM 1566 CG GLN A 94 3.450 -8.689 -11.117 1.00 13.43 C ATOM 1567 CD GLN A 94 4.193 -8.566 -12.450 1.00 10.33 C ATOM 1568 OE1 GLN A 94 4.445 -7.477 -12.945 1.00 45.53 O ATOM 1569 NE2 GLN A 94 4.537 -9.690 -13.044 1.00 22.20 N ATOM 0 H GLN A 94 1.192 -7.190 -10.087 1.00 21.14 H new ATOM 0 HA GLN A 94 3.035 -8.599 -8.362 1.00 64.24 H new ATOM 0 HB2 GLN A 94 3.418 -6.586 -10.635 1.00 75.53 H new ATOM 0 HB3 GLN A 94 4.722 -7.471 -9.869 1.00 75.53 H new ATOM 0 HG2 GLN A 94 3.760 -9.614 -10.631 1.00 13.43 H new ATOM 0 HG3 GLN A 94 2.383 -8.778 -11.321 1.00 13.43 H new ATOM 0 HE21 GLN A 94 4.315 -10.585 -12.609 1.00 22.20 H new ATOM 0 HE22 GLN A 94 5.026 -9.665 -13.939 1.00 22.20 H new ATOM 1578 N PHE A 95 2.492 -5.400 -7.826 1.00 15.34 N ATOM 1579 CA PHE A 95 2.695 -4.322 -6.832 1.00 75.50 C ATOM 1580 C PHE A 95 2.401 -4.799 -5.377 1.00 34.22 C ATOM 1581 O PHE A 95 3.306 -4.822 -4.530 1.00 53.30 O ATOM 1582 CB PHE A 95 1.820 -3.094 -7.187 1.00 53.04 C ATOM 1583 CG PHE A 95 1.915 -1.968 -6.166 1.00 62.04 C ATOM 1584 CD1 PHE A 95 3.052 -1.175 -6.092 1.00 21.54 C ATOM 1585 CD2 PHE A 95 0.883 -1.731 -5.254 1.00 4.41 C ATOM 1586 CE1 PHE A 95 3.156 -0.182 -5.149 1.00 12.42 C ATOM 1587 CE2 PHE A 95 0.992 -0.734 -4.312 1.00 31.05 C ATOM 1588 CZ PHE A 95 2.127 0.039 -4.258 1.00 0.04 C ATOM 0 H PHE A 95 1.765 -5.199 -8.513 1.00 15.34 H new ATOM 0 HA PHE A 95 3.746 -4.037 -6.870 1.00 75.50 H new ATOM 0 HB2 PHE A 95 2.119 -2.715 -8.164 1.00 53.04 H new ATOM 0 HB3 PHE A 95 0.780 -3.410 -7.272 1.00 53.04 H new ATOM 0 HD1 PHE A 95 3.864 -1.341 -6.784 1.00 21.54 H new ATOM 0 HD2 PHE A 95 -0.010 -2.337 -5.289 1.00 4.41 H new ATOM 0 HE1 PHE A 95 4.046 0.428 -5.105 1.00 12.42 H new ATOM 0 HE2 PHE A 95 0.186 -0.559 -3.615 1.00 31.05 H new ATOM 0 HZ PHE A 95 2.213 0.820 -3.517 1.00 0.04 H new ATOM 1598 N PHE A 96 1.127 -5.164 -5.097 1.00 73.01 N ATOM 1599 CA PHE A 96 0.706 -5.615 -3.748 1.00 24.54 C ATOM 1600 C PHE A 96 1.395 -6.946 -3.344 1.00 73.55 C ATOM 1601 O PHE A 96 1.545 -7.236 -2.153 1.00 11.30 O ATOM 1602 CB PHE A 96 -0.825 -5.775 -3.666 1.00 25.23 C ATOM 1603 CG PHE A 96 -1.634 -4.482 -3.811 1.00 32.12 C ATOM 1604 CD1 PHE A 96 -1.492 -3.447 -2.895 1.00 35.42 C ATOM 1605 CD2 PHE A 96 -2.558 -4.317 -4.843 1.00 61.40 C ATOM 1606 CE1 PHE A 96 -2.242 -2.291 -3.005 1.00 33.32 C ATOM 1607 CE2 PHE A 96 -3.312 -3.166 -4.949 1.00 72.32 C ATOM 1608 CZ PHE A 96 -3.155 -2.155 -4.032 1.00 63.55 C ATOM 0 H PHE A 96 0.374 -5.155 -5.785 1.00 73.01 H new ATOM 0 HA PHE A 96 1.018 -4.841 -3.047 1.00 24.54 H new ATOM 0 HB2 PHE A 96 -1.142 -6.470 -4.444 1.00 25.23 H new ATOM 0 HB3 PHE A 96 -1.074 -6.233 -2.709 1.00 25.23 H new ATOM 0 HD1 PHE A 96 -0.785 -3.547 -2.085 1.00 35.42 H new ATOM 0 HD2 PHE A 96 -2.686 -5.104 -5.572 1.00 61.40 H new ATOM 0 HE1 PHE A 96 -2.114 -1.494 -2.288 1.00 33.32 H new ATOM 0 HE2 PHE A 96 -4.025 -3.060 -5.753 1.00 72.32 H new ATOM 0 HZ PHE A 96 -3.745 -1.254 -4.114 1.00 63.55 H new ATOM 1618 N GLU A 97 1.787 -7.744 -4.359 1.00 54.40 N ATOM 1619 CA GLU A 97 2.578 -8.974 -4.164 1.00 75.31 C ATOM 1620 C GLU A 97 3.963 -8.661 -3.567 1.00 45.14 C ATOM 1621 O GLU A 97 4.353 -9.297 -2.605 1.00 71.13 O ATOM 1622 CB GLU A 97 2.722 -9.736 -5.497 1.00 61.12 C ATOM 1623 CG GLU A 97 3.538 -11.045 -5.443 1.00 22.25 C ATOM 1624 CD GLU A 97 3.713 -11.716 -6.816 1.00 54.21 C ATOM 1625 OE1 GLU A 97 3.885 -11.000 -7.830 1.00 20.21 O ATOM 1626 OE2 GLU A 97 3.682 -12.959 -6.890 1.00 31.21 O ATOM 0 H GLU A 97 1.564 -7.553 -5.336 1.00 54.40 H new ATOM 0 HA GLU A 97 2.046 -9.607 -3.454 1.00 75.31 H new ATOM 0 HB2 GLU A 97 1.724 -9.968 -5.870 1.00 61.12 H new ATOM 0 HB3 GLU A 97 3.187 -9.071 -6.225 1.00 61.12 H new ATOM 0 HG2 GLU A 97 4.521 -10.834 -5.023 1.00 22.25 H new ATOM 0 HG3 GLU A 97 3.045 -11.743 -4.766 1.00 22.25 H new ATOM 1633 N PHE A 98 4.677 -7.657 -4.135 1.00 45.34 N ATOM 1634 CA PHE A 98 5.996 -7.200 -3.623 1.00 23.54 C ATOM 1635 C PHE A 98 5.901 -6.822 -2.121 1.00 61.13 C ATOM 1636 O PHE A 98 6.742 -7.237 -1.306 1.00 62.35 O ATOM 1637 CB PHE A 98 6.526 -6.004 -4.500 1.00 72.53 C ATOM 1638 CG PHE A 98 7.300 -4.914 -3.740 1.00 21.44 C ATOM 1639 CD1 PHE A 98 8.615 -5.116 -3.300 1.00 3.42 C ATOM 1640 CD2 PHE A 98 6.685 -3.695 -3.431 1.00 41.22 C ATOM 1641 CE1 PHE A 98 9.279 -4.138 -2.580 1.00 61.23 C ATOM 1642 CE2 PHE A 98 7.357 -2.723 -2.717 1.00 0.24 C ATOM 1643 CZ PHE A 98 8.650 -2.945 -2.290 1.00 61.43 C ATOM 0 H PHE A 98 4.358 -7.143 -4.956 1.00 45.34 H new ATOM 0 HA PHE A 98 6.714 -8.016 -3.701 1.00 23.54 H new ATOM 0 HB2 PHE A 98 7.173 -6.407 -5.279 1.00 72.53 H new ATOM 0 HB3 PHE A 98 5.676 -5.539 -5.000 1.00 72.53 H new ATOM 0 HD1 PHE A 98 9.116 -6.046 -3.525 1.00 3.42 H new ATOM 0 HD2 PHE A 98 5.671 -3.512 -3.756 1.00 41.22 H new ATOM 0 HE1 PHE A 98 10.291 -4.309 -2.245 1.00 61.23 H new ATOM 0 HE2 PHE A 98 6.869 -1.786 -2.492 1.00 0.24 H new ATOM 0 HZ PHE A 98 9.170 -2.184 -1.728 1.00 61.43 H new ATOM 1653 N LEU A 99 4.855 -6.042 -1.789 1.00 3.11 N ATOM 1654 CA LEU A 99 4.570 -5.607 -0.413 1.00 74.52 C ATOM 1655 C LEU A 99 4.445 -6.817 0.539 1.00 54.23 C ATOM 1656 O LEU A 99 5.242 -6.965 1.465 1.00 42.51 O ATOM 1657 CB LEU A 99 3.275 -4.743 -0.395 1.00 44.22 C ATOM 1658 CG LEU A 99 3.350 -3.391 -1.182 1.00 10.53 C ATOM 1659 CD1 LEU A 99 1.970 -2.701 -1.273 1.00 64.41 C ATOM 1660 CD2 LEU A 99 4.404 -2.446 -0.557 1.00 1.05 C ATOM 0 H LEU A 99 4.182 -5.695 -2.473 1.00 3.11 H new ATOM 0 HA LEU A 99 5.402 -5.000 -0.057 1.00 74.52 H new ATOM 0 HB2 LEU A 99 2.458 -5.337 -0.806 1.00 44.22 H new ATOM 0 HB3 LEU A 99 3.020 -4.525 0.642 1.00 44.22 H new ATOM 0 HG LEU A 99 3.662 -3.624 -2.200 1.00 10.53 H new ATOM 0 HD11 LEU A 99 2.066 -1.767 -1.826 1.00 64.41 H new ATOM 0 HD12 LEU A 99 1.268 -3.357 -1.788 1.00 64.41 H new ATOM 0 HD13 LEU A 99 1.601 -2.492 -0.269 1.00 64.41 H new ATOM 0 HD21 LEU A 99 4.437 -1.514 -1.121 1.00 1.05 H new ATOM 0 HD22 LEU A 99 4.135 -2.234 0.478 1.00 1.05 H new ATOM 0 HD23 LEU A 99 5.384 -2.923 -0.587 1.00 1.05 H new ATOM 1672 N TYR A 100 3.488 -7.703 0.245 1.00 15.33 N ATOM 1673 CA TYR A 100 3.204 -8.890 1.071 1.00 53.20 C ATOM 1674 C TYR A 100 4.419 -9.866 1.151 1.00 44.13 C ATOM 1675 O TYR A 100 4.673 -10.452 2.210 1.00 65.30 O ATOM 1676 CB TYR A 100 1.940 -9.598 0.531 1.00 11.25 C ATOM 1677 CG TYR A 100 1.531 -10.845 1.326 1.00 35.21 C ATOM 1678 CD1 TYR A 100 0.957 -10.744 2.598 1.00 31.03 C ATOM 1679 CD2 TYR A 100 1.740 -12.121 0.810 1.00 3.31 C ATOM 1680 CE1 TYR A 100 0.609 -11.877 3.312 1.00 71.40 C ATOM 1681 CE2 TYR A 100 1.394 -13.244 1.518 1.00 0.43 C ATOM 1682 CZ TYR A 100 0.830 -13.121 2.766 1.00 72.24 C ATOM 1683 OH TYR A 100 0.485 -14.255 3.467 1.00 15.32 O ATOM 0 H TYR A 100 2.885 -7.621 -0.573 1.00 15.33 H new ATOM 0 HA TYR A 100 3.021 -8.559 2.093 1.00 53.20 H new ATOM 0 HB2 TYR A 100 1.111 -8.890 0.535 1.00 11.25 H new ATOM 0 HB3 TYR A 100 2.112 -9.883 -0.507 1.00 11.25 H new ATOM 0 HD1 TYR A 100 0.783 -9.769 3.028 1.00 31.03 H new ATOM 0 HD2 TYR A 100 2.184 -12.229 -0.169 1.00 3.31 H new ATOM 0 HE1 TYR A 100 0.166 -11.786 4.293 1.00 71.40 H new ATOM 0 HE2 TYR A 100 1.564 -14.223 1.096 1.00 0.43 H new ATOM 0 HH TYR A 100 0.708 -15.048 2.936 1.00 15.32 H new ATOM 1693 N ASN A 101 5.171 -10.008 0.039 1.00 43.23 N ATOM 1694 CA ASN A 101 6.413 -10.833 -0.008 1.00 41.45 C ATOM 1695 C ASN A 101 7.507 -10.252 0.915 1.00 74.43 C ATOM 1696 O ASN A 101 8.312 -10.996 1.478 1.00 15.31 O ATOM 1697 CB ASN A 101 6.990 -10.944 -1.450 1.00 3.22 C ATOM 1698 CG ASN A 101 6.120 -11.739 -2.427 1.00 2.34 C ATOM 1699 OD1 ASN A 101 5.315 -12.576 -2.038 1.00 50.21 O ATOM 1700 ND2 ASN A 101 6.304 -11.503 -3.713 1.00 0.43 N ATOM 0 H ASN A 101 4.943 -9.561 -0.849 1.00 43.23 H new ATOM 0 HA ASN A 101 6.128 -11.827 0.336 1.00 41.45 H new ATOM 0 HB2 ASN A 101 7.134 -9.939 -1.848 1.00 3.22 H new ATOM 0 HB3 ASN A 101 7.974 -11.410 -1.398 1.00 3.22 H new ATOM 0 HD21 ASN A 101 5.769 -12.023 -4.409 1.00 0.43 H new ATOM 0 HD22 ASN A 101 6.981 -10.800 -4.011 1.00 0.43 H new ATOM 1707 N HIS A 102 7.531 -8.915 1.047 1.00 54.21 N ATOM 1708 CA HIS A 102 8.496 -8.215 1.920 1.00 65.12 C ATOM 1709 C HIS A 102 7.967 -8.087 3.390 1.00 55.41 C ATOM 1710 O HIS A 102 8.610 -7.471 4.250 1.00 14.12 O ATOM 1711 CB HIS A 102 8.829 -6.824 1.306 1.00 1.10 C ATOM 1712 CG HIS A 102 10.089 -6.218 1.857 1.00 52.15 C ATOM 1713 ND1 HIS A 102 10.130 -5.569 3.064 1.00 65.02 N ATOM 1714 CD2 HIS A 102 11.369 -6.254 1.413 1.00 45.53 C ATOM 1715 CE1 HIS A 102 11.364 -5.245 3.344 1.00 33.40 C ATOM 1716 NE2 HIS A 102 12.140 -5.642 2.362 1.00 23.53 N ATOM 0 H HIS A 102 6.889 -8.291 0.557 1.00 54.21 H new ATOM 0 HA HIS A 102 9.410 -8.806 1.976 1.00 65.12 H new ATOM 0 HB2 HIS A 102 8.925 -6.925 0.225 1.00 1.10 H new ATOM 0 HB3 HIS A 102 7.997 -6.145 1.490 1.00 1.10 H new ATOM 0 HD1 HIS A 102 9.321 -5.370 3.653 1.00 65.02 H new ATOM 0 HD2 HIS A 102 11.715 -6.685 0.485 1.00 45.53 H new ATOM 0 HE1 HIS A 102 11.692 -4.734 4.237 1.00 33.40 H new ATOM 1725 N GLY A 103 6.795 -8.689 3.672 1.00 41.31 N ATOM 1726 CA GLY A 103 6.176 -8.640 5.008 1.00 4.15 C ATOM 1727 C GLY A 103 5.395 -7.352 5.283 1.00 61.33 C ATOM 1728 O GLY A 103 4.938 -7.135 6.405 1.00 51.34 O ATOM 0 H GLY A 103 6.256 -9.218 2.986 1.00 41.31 H new ATOM 0 HA2 GLY A 103 5.504 -9.491 5.118 1.00 4.15 H new ATOM 0 HA3 GLY A 103 6.955 -8.749 5.763 1.00 4.15 H new ATOM 1732 N ILE A 104 5.251 -6.497 4.255 1.00 22.22 N ATOM 1733 CA ILE A 104 4.493 -5.229 4.343 1.00 44.11 C ATOM 1734 C ILE A 104 2.963 -5.508 4.231 1.00 61.45 C ATOM 1735 O ILE A 104 2.518 -6.160 3.285 1.00 2.02 O ATOM 1736 CB ILE A 104 4.924 -4.210 3.211 1.00 41.32 C ATOM 1737 CG1 ILE A 104 6.486 -4.043 3.112 1.00 62.41 C ATOM 1738 CG2 ILE A 104 4.230 -2.838 3.389 1.00 21.14 C ATOM 1739 CD1 ILE A 104 7.188 -3.595 4.386 1.00 15.21 C ATOM 0 H ILE A 104 5.658 -6.664 3.335 1.00 22.22 H new ATOM 0 HA ILE A 104 4.718 -4.781 5.311 1.00 44.11 H new ATOM 0 HB ILE A 104 4.590 -4.639 2.267 1.00 41.32 H new ATOM 0 HG12 ILE A 104 6.915 -4.995 2.799 1.00 62.41 H new ATOM 0 HG13 ILE A 104 6.706 -3.321 2.326 1.00 62.41 H new ATOM 0 HG21 ILE A 104 4.549 -2.163 2.595 1.00 21.14 H new ATOM 0 HG22 ILE A 104 3.149 -2.968 3.342 1.00 21.14 H new ATOM 0 HG23 ILE A 104 4.503 -2.415 4.356 1.00 21.14 H new ATOM 0 HD11 ILE A 104 8.259 -3.513 4.202 1.00 15.21 H new ATOM 0 HD12 ILE A 104 6.798 -2.625 4.695 1.00 15.21 H new ATOM 0 HD13 ILE A 104 7.010 -4.325 5.175 1.00 15.21 H new ATOM 1751 N GLY A 105 2.189 -5.010 5.213 1.00 51.43 N ATOM 1752 CA GLY A 105 0.723 -5.118 5.235 1.00 3.11 C ATOM 1753 C GLY A 105 0.152 -6.503 5.552 1.00 1.44 C ATOM 1754 O GLY A 105 -0.962 -6.824 5.119 1.00 13.24 O ATOM 0 H GLY A 105 2.570 -4.517 6.020 1.00 51.43 H new ATOM 0 HA2 GLY A 105 0.338 -4.412 5.971 1.00 3.11 H new ATOM 0 HA3 GLY A 105 0.342 -4.804 4.263 1.00 3.11 H new ATOM 1758 N THR A 106 0.886 -7.311 6.335 1.00 2.42 N ATOM 1759 CA THR A 106 0.430 -8.674 6.726 1.00 70.25 C ATOM 1760 C THR A 106 -0.685 -8.637 7.804 1.00 74.33 C ATOM 1761 O THR A 106 -1.510 -9.552 7.881 1.00 14.32 O ATOM 1762 CB THR A 106 1.609 -9.566 7.225 1.00 45.30 C ATOM 1763 OG1 THR A 106 2.204 -8.973 8.390 1.00 54.14 O ATOM 1764 CG2 THR A 106 2.680 -9.766 6.132 1.00 40.22 C ATOM 0 H THR A 106 1.797 -7.053 6.714 1.00 2.42 H new ATOM 0 HA THR A 106 0.017 -9.117 5.820 1.00 70.25 H new ATOM 0 HB THR A 106 1.204 -10.547 7.474 1.00 45.30 H new ATOM 0 HG1 THR A 106 2.943 -9.536 8.702 1.00 54.14 H new ATOM 0 HG21 THR A 106 3.483 -10.393 6.520 1.00 40.22 H new ATOM 0 HG22 THR A 106 2.229 -10.249 5.265 1.00 40.22 H new ATOM 0 HG23 THR A 106 3.085 -8.798 5.838 1.00 40.22 H new ATOM 1772 N LEU A 107 -0.697 -7.571 8.643 1.00 31.22 N ATOM 1773 CA LEU A 107 -1.810 -7.306 9.603 1.00 31.43 C ATOM 1774 C LEU A 107 -2.738 -6.175 9.099 1.00 73.21 C ATOM 1775 O LEU A 107 -3.572 -5.663 9.855 1.00 2.34 O ATOM 1776 CB LEU A 107 -1.292 -6.964 11.033 1.00 2.25 C ATOM 1777 CG LEU A 107 -0.618 -8.116 11.848 1.00 12.21 C ATOM 1778 CD1 LEU A 107 -0.139 -7.613 13.233 1.00 10.22 C ATOM 1779 CD2 LEU A 107 -1.569 -9.320 11.997 1.00 21.31 C ATOM 0 H LEU A 107 0.050 -6.878 8.678 1.00 31.22 H new ATOM 0 HA LEU A 107 -2.382 -8.232 9.664 1.00 31.43 H new ATOM 0 HB2 LEU A 107 -0.574 -6.149 10.945 1.00 2.25 H new ATOM 0 HB3 LEU A 107 -2.133 -6.587 11.615 1.00 2.25 H new ATOM 0 HG LEU A 107 0.258 -8.448 11.291 1.00 12.21 H new ATOM 0 HD11 LEU A 107 0.326 -8.435 13.778 1.00 10.22 H new ATOM 0 HD12 LEU A 107 0.587 -6.811 13.098 1.00 10.22 H new ATOM 0 HD13 LEU A 107 -0.992 -7.239 13.799 1.00 10.22 H new ATOM 0 HD21 LEU A 107 -1.074 -10.106 12.568 1.00 21.31 H new ATOM 0 HD22 LEU A 107 -2.473 -9.007 12.519 1.00 21.31 H new ATOM 0 HD23 LEU A 107 -1.833 -9.700 11.010 1.00 21.31 H new ATOM 1791 N SER A 108 -2.623 -5.817 7.816 1.00 13.12 N ATOM 1792 CA SER A 108 -3.414 -4.722 7.217 1.00 54.43 C ATOM 1793 C SER A 108 -4.497 -5.265 6.261 1.00 63.20 C ATOM 1794 O SER A 108 -4.196 -5.613 5.116 1.00 61.45 O ATOM 1795 CB SER A 108 -2.473 -3.756 6.477 1.00 54.14 C ATOM 1796 OG SER A 108 -1.521 -3.185 7.365 1.00 22.44 O ATOM 0 H SER A 108 -1.985 -6.271 7.162 1.00 13.12 H new ATOM 0 HA SER A 108 -3.926 -4.187 8.017 1.00 54.43 H new ATOM 0 HB2 SER A 108 -1.956 -4.288 5.678 1.00 54.14 H new ATOM 0 HB3 SER A 108 -3.056 -2.964 6.007 1.00 54.14 H new ATOM 0 HG SER A 108 -1.274 -2.291 7.049 1.00 22.44 H new ATOM 1802 N SER A 109 -5.748 -5.337 6.759 1.00 41.31 N ATOM 1803 CA SER A 109 -6.936 -5.736 5.952 1.00 43.15 C ATOM 1804 C SER A 109 -7.095 -4.921 4.623 1.00 43.11 C ATOM 1805 O SER A 109 -7.186 -5.551 3.558 1.00 10.33 O ATOM 1806 CB SER A 109 -8.233 -5.645 6.800 1.00 2.21 C ATOM 1807 OG SER A 109 -9.402 -5.910 6.034 1.00 23.04 O ATOM 0 H SER A 109 -5.971 -5.122 7.731 1.00 41.31 H new ATOM 0 HA SER A 109 -6.765 -6.772 5.659 1.00 43.15 H new ATOM 0 HB2 SER A 109 -8.174 -6.354 7.626 1.00 2.21 H new ATOM 0 HB3 SER A 109 -8.308 -4.650 7.239 1.00 2.21 H new ATOM 0 HG SER A 109 -10.192 -5.843 6.609 1.00 23.04 H new ATOM 1813 N PRO A 110 -7.083 -3.528 4.633 1.00 25.24 N ATOM 1814 CA PRO A 110 -7.244 -2.711 3.384 1.00 71.32 C ATOM 1815 C PRO A 110 -6.221 -3.035 2.254 1.00 61.13 C ATOM 1816 O PRO A 110 -6.481 -2.722 1.086 1.00 32.34 O ATOM 1817 CB PRO A 110 -7.092 -1.248 3.883 1.00 4.31 C ATOM 1818 CG PRO A 110 -6.426 -1.356 5.223 1.00 13.41 C ATOM 1819 CD PRO A 110 -6.942 -2.635 5.824 1.00 61.21 C ATOM 0 HA PRO A 110 -8.202 -2.922 2.908 1.00 71.32 H new ATOM 0 HB2 PRO A 110 -6.492 -0.657 3.192 1.00 4.31 H new ATOM 0 HB3 PRO A 110 -8.062 -0.757 3.964 1.00 4.31 H new ATOM 0 HG2 PRO A 110 -5.341 -1.379 5.122 1.00 13.41 H new ATOM 0 HG3 PRO A 110 -6.669 -0.500 5.853 1.00 13.41 H new ATOM 0 HD2 PRO A 110 -6.248 -3.046 6.558 1.00 61.21 H new ATOM 0 HD3 PRO A 110 -7.894 -2.487 6.334 1.00 61.21 H new ATOM 1827 N LEU A 111 -5.068 -3.653 2.603 1.00 2.43 N ATOM 1828 CA LEU A 111 -4.081 -4.116 1.596 1.00 72.31 C ATOM 1829 C LEU A 111 -4.660 -5.292 0.768 1.00 45.40 C ATOM 1830 O LEU A 111 -4.690 -5.240 -0.465 1.00 22.34 O ATOM 1831 CB LEU A 111 -2.744 -4.568 2.248 1.00 32.01 C ATOM 1832 CG LEU A 111 -1.591 -4.857 1.224 1.00 43.14 C ATOM 1833 CD1 LEU A 111 -1.040 -3.544 0.632 1.00 32.14 C ATOM 1834 CD2 LEU A 111 -0.468 -5.733 1.821 1.00 41.33 C ATOM 0 H LEU A 111 -4.798 -3.842 3.568 1.00 2.43 H new ATOM 0 HA LEU A 111 -3.875 -3.266 0.946 1.00 72.31 H new ATOM 0 HB2 LEU A 111 -2.412 -3.796 2.942 1.00 32.01 H new ATOM 0 HB3 LEU A 111 -2.926 -5.468 2.836 1.00 32.01 H new ATOM 0 HG LEU A 111 -2.025 -5.438 0.411 1.00 43.14 H new ATOM 0 HD11 LEU A 111 -0.242 -3.770 -0.075 1.00 32.14 H new ATOM 0 HD12 LEU A 111 -1.841 -3.013 0.117 1.00 32.14 H new ATOM 0 HD13 LEU A 111 -0.647 -2.920 1.435 1.00 32.14 H new ATOM 0 HD21 LEU A 111 0.302 -5.900 1.068 1.00 41.33 H new ATOM 0 HD22 LEU A 111 -0.030 -5.227 2.681 1.00 41.33 H new ATOM 0 HD23 LEU A 111 -0.882 -6.691 2.135 1.00 41.33 H new ATOM 1846 N TYR A 112 -5.125 -6.341 1.484 1.00 44.24 N ATOM 1847 CA TYR A 112 -5.724 -7.551 0.873 1.00 41.03 C ATOM 1848 C TYR A 112 -7.014 -7.218 0.094 1.00 41.42 C ATOM 1849 O TYR A 112 -7.279 -7.808 -0.949 1.00 34.35 O ATOM 1850 CB TYR A 112 -6.051 -8.605 1.959 1.00 14.53 C ATOM 1851 CG TYR A 112 -4.843 -9.094 2.771 1.00 73.01 C ATOM 1852 CD1 TYR A 112 -4.044 -10.143 2.312 1.00 64.14 C ATOM 1853 CD2 TYR A 112 -4.515 -8.522 4.004 1.00 30.45 C ATOM 1854 CE1 TYR A 112 -2.976 -10.604 3.053 1.00 14.21 C ATOM 1855 CE2 TYR A 112 -3.441 -8.977 4.742 1.00 53.21 C ATOM 1856 CZ TYR A 112 -2.680 -10.019 4.266 1.00 41.22 C ATOM 1857 OH TYR A 112 -1.630 -10.493 5.012 1.00 34.51 O ATOM 0 H TYR A 112 -5.096 -6.373 2.503 1.00 44.24 H new ATOM 0 HA TYR A 112 -4.988 -7.953 0.176 1.00 41.03 H new ATOM 0 HB2 TYR A 112 -6.785 -8.182 2.646 1.00 14.53 H new ATOM 0 HB3 TYR A 112 -6.521 -9.464 1.481 1.00 14.53 H new ATOM 0 HD1 TYR A 112 -4.266 -10.602 1.360 1.00 64.14 H new ATOM 0 HD2 TYR A 112 -5.114 -7.708 4.386 1.00 30.45 H new ATOM 0 HE1 TYR A 112 -2.373 -11.421 2.684 1.00 14.21 H new ATOM 0 HE2 TYR A 112 -3.199 -8.517 5.689 1.00 53.21 H new ATOM 0 HH TYR A 112 -1.754 -10.239 5.950 1.00 34.51 H new ATOM 1867 N ILE A 113 -7.813 -6.287 0.644 1.00 23.25 N ATOM 1868 CA ILE A 113 -9.061 -5.808 0.009 1.00 42.22 C ATOM 1869 C ILE A 113 -8.767 -5.101 -1.347 1.00 23.55 C ATOM 1870 O ILE A 113 -9.426 -5.387 -2.359 1.00 31.12 O ATOM 1871 CB ILE A 113 -9.855 -4.842 0.970 1.00 42.13 C ATOM 1872 CG1 ILE A 113 -10.145 -5.530 2.345 1.00 11.42 C ATOM 1873 CG2 ILE A 113 -11.169 -4.331 0.322 1.00 1.52 C ATOM 1874 CD1 ILE A 113 -10.957 -6.815 2.283 1.00 0.15 C ATOM 0 H ILE A 113 -7.615 -5.843 1.541 1.00 23.25 H new ATOM 0 HA ILE A 113 -9.683 -6.681 -0.188 1.00 42.22 H new ATOM 0 HB ILE A 113 -9.220 -3.974 1.148 1.00 42.13 H new ATOM 0 HG12 ILE A 113 -9.193 -5.747 2.830 1.00 11.42 H new ATOM 0 HG13 ILE A 113 -10.672 -4.819 2.982 1.00 11.42 H new ATOM 0 HG21 ILE A 113 -11.684 -3.669 1.018 1.00 1.52 H new ATOM 0 HG22 ILE A 113 -10.936 -3.786 -0.592 1.00 1.52 H new ATOM 0 HG23 ILE A 113 -11.811 -5.179 0.085 1.00 1.52 H new ATOM 0 HD11 ILE A 113 -11.098 -7.205 3.291 1.00 0.15 H new ATOM 0 HD12 ILE A 113 -11.929 -6.610 1.834 1.00 0.15 H new ATOM 0 HD13 ILE A 113 -10.427 -7.552 1.680 1.00 0.15 H new ATOM 1886 N ALA A 114 -7.757 -4.208 -1.354 1.00 41.10 N ATOM 1887 CA ALA A 114 -7.325 -3.486 -2.576 1.00 35.33 C ATOM 1888 C ALA A 114 -6.697 -4.436 -3.629 1.00 42.23 C ATOM 1889 O ALA A 114 -6.898 -4.261 -4.837 1.00 3.30 O ATOM 1890 CB ALA A 114 -6.343 -2.365 -2.200 1.00 34.02 C ATOM 0 H ALA A 114 -7.219 -3.966 -0.522 1.00 41.10 H new ATOM 0 HA ALA A 114 -8.212 -3.050 -3.035 1.00 35.33 H new ATOM 0 HB1 ALA A 114 -6.029 -1.839 -3.101 1.00 34.02 H new ATOM 0 HB2 ALA A 114 -6.832 -1.665 -1.523 1.00 34.02 H new ATOM 0 HB3 ALA A 114 -5.470 -2.795 -1.709 1.00 34.02 H new ATOM 1896 N TRP A 115 -5.950 -5.442 -3.146 1.00 73.00 N ATOM 1897 CA TRP A 115 -5.292 -6.453 -4.001 1.00 21.42 C ATOM 1898 C TRP A 115 -6.350 -7.353 -4.697 1.00 43.52 C ATOM 1899 O TRP A 115 -6.431 -7.389 -5.935 1.00 10.34 O ATOM 1900 CB TRP A 115 -4.310 -7.291 -3.127 1.00 41.34 C ATOM 1901 CG TRP A 115 -3.368 -8.225 -3.874 1.00 13.25 C ATOM 1902 CD1 TRP A 115 -3.260 -8.420 -5.228 1.00 14.41 C ATOM 1903 CD2 TRP A 115 -2.365 -9.069 -3.280 1.00 3.31 C ATOM 1904 NE1 TRP A 115 -2.302 -9.358 -5.496 1.00 73.05 N ATOM 1905 CE2 TRP A 115 -1.734 -9.764 -4.323 1.00 1.33 C ATOM 1906 CE3 TRP A 115 -1.951 -9.314 -1.961 1.00 11.10 C ATOM 1907 CZ2 TRP A 115 -0.724 -10.689 -4.095 1.00 73.11 C ATOM 1908 CZ3 TRP A 115 -0.942 -10.228 -1.738 1.00 23.01 C ATOM 1909 CH2 TRP A 115 -0.337 -10.907 -2.804 1.00 13.45 C ATOM 0 H TRP A 115 -5.783 -5.581 -2.149 1.00 73.00 H new ATOM 0 HA TRP A 115 -4.725 -5.958 -4.790 1.00 21.42 H new ATOM 0 HB2 TRP A 115 -3.709 -6.603 -2.533 1.00 41.34 H new ATOM 0 HB3 TRP A 115 -4.898 -7.886 -2.428 1.00 41.34 H new ATOM 0 HD1 TRP A 115 -3.847 -7.906 -5.975 1.00 14.41 H new ATOM 0 HE1 TRP A 115 -2.052 -9.700 -6.424 1.00 73.05 H new ATOM 0 HE3 TRP A 115 -2.415 -8.796 -1.135 1.00 11.10 H new ATOM 0 HZ2 TRP A 115 -0.259 -11.219 -4.913 1.00 73.11 H new ATOM 0 HZ3 TRP A 115 -0.614 -10.423 -0.728 1.00 23.01 H new ATOM 0 HH2 TRP A 115 0.451 -11.617 -2.600 1.00 13.45 H new ATOM 1920 N ALA A 116 -7.166 -8.036 -3.876 1.00 34.43 N ATOM 1921 CA ALA A 116 -8.250 -8.928 -4.336 1.00 52.30 C ATOM 1922 C ALA A 116 -9.275 -8.202 -5.239 1.00 34.45 C ATOM 1923 O ALA A 116 -9.812 -8.799 -6.179 1.00 62.32 O ATOM 1924 CB ALA A 116 -8.950 -9.543 -3.123 1.00 14.11 C ATOM 0 H ALA A 116 -7.092 -7.985 -2.860 1.00 34.43 H new ATOM 0 HA ALA A 116 -7.799 -9.712 -4.944 1.00 52.30 H new ATOM 0 HB1 ALA A 116 -9.750 -10.202 -3.460 1.00 14.11 H new ATOM 0 HB2 ALA A 116 -8.230 -10.116 -2.539 1.00 14.11 H new ATOM 0 HB3 ALA A 116 -9.369 -8.750 -2.504 1.00 14.11 H new ATOM 1930 N GLY A 117 -9.521 -6.909 -4.931 1.00 60.32 N ATOM 1931 CA GLY A 117 -10.370 -6.044 -5.755 1.00 41.13 C ATOM 1932 C GLY A 117 -9.862 -5.885 -7.189 1.00 10.23 C ATOM 1933 O GLY A 117 -10.637 -5.976 -8.145 1.00 35.12 O ATOM 0 H GLY A 117 -9.136 -6.446 -4.108 1.00 60.32 H new ATOM 0 HA2 GLY A 117 -11.380 -6.454 -5.778 1.00 41.13 H new ATOM 0 HA3 GLY A 117 -10.435 -5.061 -5.289 1.00 41.13 H new ATOM 1937 N HIS A 118 -8.542 -5.665 -7.333 1.00 24.14 N ATOM 1938 CA HIS A 118 -7.882 -5.571 -8.653 1.00 61.42 C ATOM 1939 C HIS A 118 -7.976 -6.906 -9.424 1.00 14.12 C ATOM 1940 O HIS A 118 -8.342 -6.917 -10.597 1.00 71.11 O ATOM 1941 CB HIS A 118 -6.398 -5.158 -8.479 1.00 62.12 C ATOM 1942 CG HIS A 118 -5.588 -5.181 -9.756 1.00 60.32 C ATOM 1943 ND1 HIS A 118 -5.640 -4.184 -10.712 1.00 71.54 N ATOM 1944 CD2 HIS A 118 -4.681 -6.081 -10.219 1.00 62.44 C ATOM 1945 CE1 HIS A 118 -4.812 -4.474 -11.696 1.00 3.15 C ATOM 1946 NE2 HIS A 118 -4.221 -5.614 -11.422 1.00 60.23 N ATOM 0 H HIS A 118 -7.905 -5.548 -6.545 1.00 24.14 H new ATOM 0 HA HIS A 118 -8.400 -4.809 -9.235 1.00 61.42 H new ATOM 0 HB2 HIS A 118 -6.360 -4.153 -8.058 1.00 62.12 H new ATOM 0 HB3 HIS A 118 -5.931 -5.825 -7.755 1.00 62.12 H new ATOM 0 HD2 HIS A 118 -4.379 -6.995 -9.729 1.00 62.44 H new ATOM 0 HE1 HIS A 118 -4.647 -3.875 -12.579 1.00 3.15 H new ATOM 0 HE2 HIS A 118 -3.530 -6.078 -12.011 1.00 60.23 H new ATOM 1955 N LEU A 119 -7.638 -8.016 -8.736 1.00 11.54 N ATOM 1956 CA LEU A 119 -7.563 -9.363 -9.352 1.00 62.51 C ATOM 1957 C LEU A 119 -8.934 -9.814 -9.922 1.00 52.01 C ATOM 1958 O LEU A 119 -9.011 -10.322 -11.044 1.00 44.35 O ATOM 1959 CB LEU A 119 -7.052 -10.389 -8.309 1.00 2.14 C ATOM 1960 CG LEU A 119 -5.700 -10.059 -7.613 1.00 14.34 C ATOM 1961 CD1 LEU A 119 -5.317 -11.137 -6.580 1.00 12.12 C ATOM 1962 CD2 LEU A 119 -4.587 -9.847 -8.649 1.00 41.21 C ATOM 0 H LEU A 119 -7.410 -8.008 -7.742 1.00 11.54 H new ATOM 0 HA LEU A 119 -6.864 -9.312 -10.186 1.00 62.51 H new ATOM 0 HB2 LEU A 119 -7.814 -10.500 -7.538 1.00 2.14 H new ATOM 0 HB3 LEU A 119 -6.955 -11.356 -8.802 1.00 2.14 H new ATOM 0 HG LEU A 119 -5.826 -9.124 -7.067 1.00 14.34 H new ATOM 0 HD11 LEU A 119 -4.368 -10.873 -6.114 1.00 12.12 H new ATOM 0 HD12 LEU A 119 -6.091 -11.200 -5.815 1.00 12.12 H new ATOM 0 HD13 LEU A 119 -5.221 -12.101 -7.079 1.00 12.12 H new ATOM 0 HD21 LEU A 119 -3.652 -9.618 -8.137 1.00 41.21 H new ATOM 0 HD22 LEU A 119 -4.463 -10.754 -9.241 1.00 41.21 H new ATOM 0 HD23 LEU A 119 -4.854 -9.019 -9.305 1.00 41.21 H new ATOM 1974 N GLU A 120 -10.002 -9.603 -9.125 1.00 31.41 N ATOM 1975 CA GLU A 120 -11.409 -9.842 -9.532 1.00 10.12 C ATOM 1976 C GLU A 120 -11.736 -9.218 -10.906 1.00 35.11 C ATOM 1977 O GLU A 120 -12.242 -9.908 -11.801 1.00 32.00 O ATOM 1978 CB GLU A 120 -12.362 -9.261 -8.456 1.00 34.24 C ATOM 1979 CG GLU A 120 -13.848 -9.238 -8.862 1.00 63.44 C ATOM 1980 CD GLU A 120 -14.779 -8.744 -7.753 1.00 4.41 C ATOM 1981 OE1 GLU A 120 -14.958 -7.517 -7.610 1.00 3.11 O ATOM 1982 OE2 GLU A 120 -15.335 -9.585 -7.026 1.00 1.14 O ATOM 0 H GLU A 120 -9.914 -9.258 -8.169 1.00 31.41 H new ATOM 0 HA GLU A 120 -11.548 -10.919 -9.622 1.00 10.12 H new ATOM 0 HB2 GLU A 120 -12.257 -9.846 -7.542 1.00 34.24 H new ATOM 0 HB3 GLU A 120 -12.047 -8.244 -8.221 1.00 34.24 H new ATOM 0 HG2 GLU A 120 -13.967 -8.598 -9.736 1.00 63.44 H new ATOM 0 HG3 GLU A 120 -14.151 -10.242 -9.158 1.00 63.44 H new ATOM 1989 N ALA A 121 -11.410 -7.917 -11.046 1.00 71.21 N ATOM 1990 CA ALA A 121 -11.644 -7.143 -12.283 1.00 73.12 C ATOM 1991 C ALA A 121 -10.955 -7.781 -13.511 1.00 22.25 C ATOM 1992 O ALA A 121 -11.527 -7.822 -14.604 1.00 64.32 O ATOM 1993 CB ALA A 121 -11.180 -5.687 -12.089 1.00 51.35 C ATOM 0 H ALA A 121 -10.975 -7.371 -10.302 1.00 71.21 H new ATOM 0 HA ALA A 121 -12.716 -7.153 -12.483 1.00 73.12 H new ATOM 0 HB1 ALA A 121 -11.356 -5.124 -13.005 1.00 51.35 H new ATOM 0 HB2 ALA A 121 -11.739 -5.233 -11.271 1.00 51.35 H new ATOM 0 HB3 ALA A 121 -10.116 -5.673 -11.853 1.00 51.35 H new ATOM 1999 N GLN A 122 -9.740 -8.314 -13.296 1.00 3.11 N ATOM 2000 CA GLN A 122 -8.944 -8.977 -14.354 1.00 75.54 C ATOM 2001 C GLN A 122 -9.525 -10.371 -14.708 1.00 45.41 C ATOM 2002 O GLN A 122 -9.421 -10.820 -15.853 1.00 40.40 O ATOM 2003 CB GLN A 122 -7.462 -9.110 -13.895 1.00 24.10 C ATOM 2004 CG GLN A 122 -6.868 -7.809 -13.311 1.00 60.33 C ATOM 2005 CD GLN A 122 -6.878 -6.621 -14.280 1.00 54.12 C ATOM 2006 OE1 GLN A 122 -6.705 -6.770 -15.486 1.00 30.43 O ATOM 2007 NE2 GLN A 122 -7.125 -5.438 -13.768 1.00 24.23 N ATOM 0 H GLN A 122 -9.279 -8.300 -12.386 1.00 3.11 H new ATOM 0 HA GLN A 122 -8.990 -8.361 -15.252 1.00 75.54 H new ATOM 0 HB2 GLN A 122 -7.394 -9.898 -13.145 1.00 24.10 H new ATOM 0 HB3 GLN A 122 -6.856 -9.425 -14.744 1.00 24.10 H new ATOM 0 HG2 GLN A 122 -7.428 -7.538 -12.416 1.00 60.33 H new ATOM 0 HG3 GLN A 122 -5.841 -8.000 -12.999 1.00 60.33 H new ATOM 0 HE21 GLN A 122 -7.266 -5.337 -12.763 1.00 24.23 H new ATOM 0 HE22 GLN A 122 -7.176 -4.620 -14.375 1.00 24.23 H new ATOM 2016 N GLY A 123 -10.133 -11.045 -13.708 1.00 12.33 N ATOM 2017 CA GLY A 123 -10.692 -12.402 -13.878 1.00 24.33 C ATOM 2018 C GLY A 123 -10.124 -13.407 -12.871 1.00 52.14 C ATOM 2019 O GLY A 123 -10.566 -14.554 -12.814 1.00 42.44 O ATOM 0 H GLY A 123 -10.249 -10.667 -12.768 1.00 12.33 H new ATOM 0 HA2 GLY A 123 -11.776 -12.360 -13.771 1.00 24.33 H new ATOM 0 HA3 GLY A 123 -10.485 -12.751 -14.890 1.00 24.33 H new ATOM 2023 N GLU A 124 -9.151 -12.941 -12.070 1.00 21.41 N ATOM 2024 CA GLU A 124 -8.435 -13.740 -11.046 1.00 60.43 C ATOM 2025 C GLU A 124 -9.251 -13.861 -9.725 1.00 14.41 C ATOM 2026 O GLU A 124 -8.743 -13.562 -8.645 1.00 21.44 O ATOM 2027 CB GLU A 124 -7.070 -13.072 -10.756 1.00 63.41 C ATOM 2028 CG GLU A 124 -6.153 -12.873 -11.965 1.00 15.12 C ATOM 2029 CD GLU A 124 -4.928 -12.004 -11.639 1.00 74.31 C ATOM 2030 OE1 GLU A 124 -4.047 -12.468 -10.890 1.00 74.13 O ATOM 2031 OE2 GLU A 124 -4.844 -10.857 -12.122 1.00 50.34 O ATOM 0 H GLU A 124 -8.828 -11.974 -12.113 1.00 21.41 H new ATOM 0 HA GLU A 124 -8.295 -14.748 -11.436 1.00 60.43 H new ATOM 0 HB2 GLU A 124 -7.253 -12.099 -10.299 1.00 63.41 H new ATOM 0 HB3 GLU A 124 -6.541 -13.676 -10.019 1.00 63.41 H new ATOM 0 HG2 GLU A 124 -5.819 -13.845 -12.327 1.00 15.12 H new ATOM 0 HG3 GLU A 124 -6.718 -12.409 -12.773 1.00 15.12 H new ATOM 2038 N LEU A 125 -10.509 -14.306 -9.828 1.00 2.40 N ATOM 2039 CA LEU A 125 -11.418 -14.514 -8.674 1.00 41.45 C ATOM 2040 C LEU A 125 -10.887 -15.578 -7.667 1.00 55.22 C ATOM 2041 O LEU A 125 -10.933 -15.365 -6.454 1.00 33.12 O ATOM 2042 CB LEU A 125 -12.828 -14.885 -9.217 1.00 63.41 C ATOM 2043 CG LEU A 125 -13.672 -13.682 -9.768 1.00 75.52 C ATOM 2044 CD1 LEU A 125 -14.779 -14.139 -10.737 1.00 34.45 C ATOM 2045 CD2 LEU A 125 -14.268 -12.867 -8.603 1.00 44.00 C ATOM 0 H LEU A 125 -10.938 -14.537 -10.724 1.00 2.40 H new ATOM 0 HA LEU A 125 -11.474 -13.587 -8.104 1.00 41.45 H new ATOM 0 HB2 LEU A 125 -12.711 -15.620 -10.013 1.00 63.41 H new ATOM 0 HB3 LEU A 125 -13.392 -15.367 -8.418 1.00 63.41 H new ATOM 0 HG LEU A 125 -12.996 -13.045 -10.338 1.00 75.52 H new ATOM 0 HD11 LEU A 125 -15.335 -13.270 -11.090 1.00 34.45 H new ATOM 0 HD12 LEU A 125 -14.329 -14.653 -11.587 1.00 34.45 H new ATOM 0 HD13 LEU A 125 -15.457 -14.818 -10.220 1.00 34.45 H new ATOM 0 HD21 LEU A 125 -14.851 -12.036 -9.001 1.00 44.00 H new ATOM 0 HD22 LEU A 125 -14.914 -13.508 -8.003 1.00 44.00 H new ATOM 0 HD23 LEU A 125 -13.462 -12.479 -7.980 1.00 44.00 H new ATOM 2057 N GLN A 126 -10.365 -16.701 -8.176 1.00 60.42 N ATOM 2058 CA GLN A 126 -9.800 -17.780 -7.327 1.00 60.43 C ATOM 2059 C GLN A 126 -8.465 -17.337 -6.650 1.00 5.14 C ATOM 2060 O GLN A 126 -8.202 -17.692 -5.497 1.00 10.22 O ATOM 2061 CB GLN A 126 -9.608 -19.080 -8.170 1.00 4.41 C ATOM 2062 CG GLN A 126 -10.905 -19.877 -8.494 1.00 71.21 C ATOM 2063 CD GLN A 126 -11.987 -19.086 -9.253 1.00 70.11 C ATOM 2064 OE1 GLN A 126 -11.993 -19.030 -10.474 1.00 62.50 O ATOM 2065 NE2 GLN A 126 -12.918 -18.481 -8.539 1.00 44.33 N ATOM 0 H GLN A 126 -10.318 -16.895 -9.176 1.00 60.42 H new ATOM 0 HA GLN A 126 -10.507 -17.990 -6.525 1.00 60.43 H new ATOM 0 HB2 GLN A 126 -9.125 -18.813 -9.110 1.00 4.41 H new ATOM 0 HB3 GLN A 126 -8.924 -19.739 -7.636 1.00 4.41 H new ATOM 0 HG2 GLN A 126 -10.636 -20.753 -9.084 1.00 71.21 H new ATOM 0 HG3 GLN A 126 -11.332 -20.241 -7.559 1.00 71.21 H new ATOM 0 HE21 GLN A 126 -12.897 -18.538 -7.521 1.00 44.33 H new ATOM 0 HE22 GLN A 126 -13.658 -17.956 -9.005 1.00 44.33 H new ATOM 2074 N HIS A 127 -7.649 -16.543 -7.373 1.00 53.02 N ATOM 2075 CA HIS A 127 -6.387 -15.970 -6.841 1.00 1.33 C ATOM 2076 C HIS A 127 -6.671 -14.886 -5.765 1.00 22.43 C ATOM 2077 O HIS A 127 -5.964 -14.786 -4.764 1.00 61.40 O ATOM 2078 CB HIS A 127 -5.547 -15.375 -8.007 1.00 44.34 C ATOM 2079 CG HIS A 127 -4.235 -14.761 -7.595 1.00 35.42 C ATOM 2080 ND1 HIS A 127 -3.717 -13.623 -8.166 1.00 33.14 N ATOM 2081 CD2 HIS A 127 -3.336 -15.135 -6.652 1.00 22.30 C ATOM 2082 CE1 HIS A 127 -2.568 -13.337 -7.601 1.00 3.11 C ATOM 2083 NE2 HIS A 127 -2.318 -14.234 -6.681 1.00 1.03 N ATOM 0 H HIS A 127 -7.842 -16.279 -8.339 1.00 53.02 H new ATOM 0 HA HIS A 127 -5.820 -16.769 -6.363 1.00 1.33 H new ATOM 0 HB2 HIS A 127 -5.350 -16.164 -8.733 1.00 44.34 H new ATOM 0 HB3 HIS A 127 -6.143 -14.616 -8.514 1.00 44.34 H new ATOM 0 HD1 HIS A 127 -4.157 -13.085 -8.912 1.00 33.14 H new ATOM 0 HD2 HIS A 127 -3.414 -15.991 -5.998 1.00 22.30 H new ATOM 0 HE1 HIS A 127 -1.934 -12.500 -7.853 1.00 3.11 H new ATOM 2092 N ALA A 128 -7.700 -14.078 -6.007 1.00 63.14 N ATOM 2093 CA ALA A 128 -8.146 -13.020 -5.082 1.00 61.42 C ATOM 2094 C ALA A 128 -8.760 -13.595 -3.793 1.00 53.54 C ATOM 2095 O ALA A 128 -8.583 -13.036 -2.708 1.00 53.05 O ATOM 2096 CB ALA A 128 -9.138 -12.133 -5.808 1.00 74.13 C ATOM 0 H ALA A 128 -8.259 -14.134 -6.858 1.00 63.14 H new ATOM 0 HA ALA A 128 -7.280 -12.436 -4.772 1.00 61.42 H new ATOM 0 HB1 ALA A 128 -9.479 -11.344 -5.138 1.00 74.13 H new ATOM 0 HB2 ALA A 128 -8.658 -11.687 -6.679 1.00 74.13 H new ATOM 0 HB3 ALA A 128 -9.992 -12.729 -6.130 1.00 74.13 H new ATOM 2102 N SER A 129 -9.484 -14.716 -3.941 1.00 11.33 N ATOM 2103 CA SER A 129 -9.958 -15.532 -2.800 1.00 63.32 C ATOM 2104 C SER A 129 -8.758 -16.047 -1.974 1.00 75.04 C ATOM 2105 O SER A 129 -8.775 -16.010 -0.737 1.00 64.32 O ATOM 2106 CB SER A 129 -10.807 -16.723 -3.304 1.00 41.34 C ATOM 2107 OG SER A 129 -11.250 -17.539 -2.229 1.00 50.14 O ATOM 0 H SER A 129 -9.759 -15.086 -4.851 1.00 11.33 H new ATOM 0 HA SER A 129 -10.580 -14.905 -2.162 1.00 63.32 H new ATOM 0 HB2 SER A 129 -11.669 -16.349 -3.857 1.00 41.34 H new ATOM 0 HB3 SER A 129 -10.218 -17.322 -3.999 1.00 41.34 H new ATOM 0 HG SER A 129 -11.785 -18.281 -2.581 1.00 50.14 H new ATOM 2113 N ALA A 130 -7.697 -16.480 -2.700 1.00 34.04 N ATOM 2114 CA ALA A 130 -6.422 -16.933 -2.106 1.00 55.50 C ATOM 2115 C ALA A 130 -5.668 -15.785 -1.381 1.00 41.04 C ATOM 2116 O ALA A 130 -4.822 -16.048 -0.534 1.00 14.21 O ATOM 2117 CB ALA A 130 -5.524 -17.575 -3.179 1.00 23.15 C ATOM 0 H ALA A 130 -7.706 -16.523 -3.719 1.00 34.04 H new ATOM 0 HA ALA A 130 -6.667 -17.682 -1.353 1.00 55.50 H new ATOM 0 HB1 ALA A 130 -4.590 -17.902 -2.723 1.00 23.15 H new ATOM 0 HB2 ALA A 130 -6.035 -18.433 -3.615 1.00 23.15 H new ATOM 0 HB3 ALA A 130 -5.310 -16.845 -3.959 1.00 23.15 H new ATOM 2123 N VAL A 131 -5.970 -14.522 -1.734 1.00 5.01 N ATOM 2124 CA VAL A 131 -5.407 -13.328 -1.052 1.00 65.31 C ATOM 2125 C VAL A 131 -6.199 -12.978 0.236 1.00 63.03 C ATOM 2126 O VAL A 131 -5.605 -12.708 1.284 1.00 33.35 O ATOM 2127 CB VAL A 131 -5.369 -12.090 -2.040 1.00 24.23 C ATOM 2128 CG1 VAL A 131 -5.065 -10.759 -1.314 1.00 3.50 C ATOM 2129 CG2 VAL A 131 -4.355 -12.347 -3.183 1.00 4.12 C ATOM 0 H VAL A 131 -6.608 -14.294 -2.496 1.00 5.01 H new ATOM 0 HA VAL A 131 -4.386 -13.568 -0.754 1.00 65.31 H new ATOM 0 HB VAL A 131 -6.366 -11.986 -2.468 1.00 24.23 H new ATOM 0 HG11 VAL A 131 -5.051 -9.944 -2.038 1.00 3.50 H new ATOM 0 HG12 VAL A 131 -5.836 -10.567 -0.567 1.00 3.50 H new ATOM 0 HG13 VAL A 131 -4.094 -10.826 -0.824 1.00 3.50 H new ATOM 0 HG21 VAL A 131 -4.339 -11.489 -3.855 1.00 4.12 H new ATOM 0 HG22 VAL A 131 -3.361 -12.496 -2.761 1.00 4.12 H new ATOM 0 HG23 VAL A 131 -4.651 -13.237 -3.739 1.00 4.12 H new ATOM 2139 N LEU A 132 -7.534 -13.002 0.146 1.00 22.33 N ATOM 2140 CA LEU A 132 -8.429 -12.650 1.281 1.00 40.33 C ATOM 2141 C LEU A 132 -8.316 -13.668 2.441 1.00 42.02 C ATOM 2142 O LEU A 132 -8.357 -13.282 3.617 1.00 32.20 O ATOM 2143 CB LEU A 132 -9.895 -12.531 0.793 1.00 13.20 C ATOM 2144 CG LEU A 132 -10.195 -11.357 -0.188 1.00 14.34 C ATOM 2145 CD1 LEU A 132 -11.648 -11.405 -0.701 1.00 74.54 C ATOM 2146 CD2 LEU A 132 -9.878 -9.986 0.459 1.00 12.04 C ATOM 0 H LEU A 132 -8.032 -13.263 -0.705 1.00 22.33 H new ATOM 0 HA LEU A 132 -8.108 -11.683 1.669 1.00 40.33 H new ATOM 0 HB2 LEU A 132 -10.172 -13.466 0.305 1.00 13.20 H new ATOM 0 HB3 LEU A 132 -10.540 -12.423 1.665 1.00 13.20 H new ATOM 0 HG LEU A 132 -9.538 -11.479 -1.049 1.00 14.34 H new ATOM 0 HD11 LEU A 132 -11.821 -10.572 -1.382 1.00 74.54 H new ATOM 0 HD12 LEU A 132 -11.817 -12.345 -1.227 1.00 74.54 H new ATOM 0 HD13 LEU A 132 -12.334 -11.332 0.143 1.00 74.54 H new ATOM 0 HD21 LEU A 132 -10.098 -9.189 -0.251 1.00 12.04 H new ATOM 0 HD22 LEU A 132 -10.489 -9.855 1.352 1.00 12.04 H new ATOM 0 HD23 LEU A 132 -8.823 -9.948 0.732 1.00 12.04 H new ATOM 2158 N GLN A 133 -8.149 -14.966 2.093 1.00 21.34 N ATOM 2159 CA GLN A 133 -7.907 -16.026 3.098 1.00 23.54 C ATOM 2160 C GLN A 133 -6.573 -15.793 3.854 1.00 33.02 C ATOM 2161 O GLN A 133 -6.479 -16.105 5.037 1.00 10.43 O ATOM 2162 CB GLN A 133 -7.922 -17.444 2.468 1.00 62.02 C ATOM 2163 CG GLN A 133 -6.830 -17.702 1.424 1.00 1.14 C ATOM 2164 CD GLN A 133 -6.785 -19.151 0.925 1.00 52.21 C ATOM 2165 OE1 GLN A 133 -7.443 -19.510 -0.046 1.00 42.21 O ATOM 2166 NE2 GLN A 133 -6.006 -19.990 1.580 1.00 54.25 N ATOM 0 H GLN A 133 -8.177 -15.302 1.130 1.00 21.34 H new ATOM 0 HA GLN A 133 -8.728 -15.969 3.812 1.00 23.54 H new ATOM 0 HB2 GLN A 133 -7.822 -18.180 3.266 1.00 62.02 H new ATOM 0 HB3 GLN A 133 -8.894 -17.608 2.003 1.00 62.02 H new ATOM 0 HG2 GLN A 133 -6.989 -17.039 0.574 1.00 1.14 H new ATOM 0 HG3 GLN A 133 -5.862 -17.444 1.853 1.00 1.14 H new ATOM 0 HE21 GLN A 133 -5.469 -19.665 2.384 1.00 54.25 H new ATOM 0 HE22 GLN A 133 -5.940 -20.963 1.282 1.00 54.25 H new ATOM 2175 N ARG A 134 -5.557 -15.217 3.157 1.00 13.01 N ATOM 2176 CA ARG A 134 -4.262 -14.856 3.778 1.00 23.01 C ATOM 2177 C ARG A 134 -4.463 -13.840 4.905 1.00 43.03 C ATOM 2178 O ARG A 134 -3.908 -14.003 5.975 1.00 14.23 O ATOM 2179 CB ARG A 134 -3.266 -14.288 2.744 1.00 3.12 C ATOM 2180 CG ARG A 134 -2.779 -15.306 1.709 1.00 22.23 C ATOM 2181 CD ARG A 134 -1.803 -14.684 0.696 1.00 24.43 C ATOM 2182 NE ARG A 134 -1.059 -15.709 -0.050 1.00 55.21 N ATOM 2183 CZ ARG A 134 -1.319 -16.119 -1.263 1.00 12.23 C ATOM 2184 NH1 ARG A 134 -2.336 -15.662 -1.929 1.00 14.15 N ATOM 2185 NH2 ARG A 134 -0.548 -16.994 -1.803 1.00 51.00 N ATOM 0 H ARG A 134 -5.614 -14.994 2.163 1.00 13.01 H new ATOM 0 HA ARG A 134 -3.842 -15.774 4.189 1.00 23.01 H new ATOM 0 HB2 ARG A 134 -3.738 -13.455 2.222 1.00 3.12 H new ATOM 0 HB3 ARG A 134 -2.403 -13.885 3.273 1.00 3.12 H new ATOM 0 HG2 ARG A 134 -2.290 -16.135 2.220 1.00 22.23 H new ATOM 0 HG3 ARG A 134 -3.636 -15.720 1.178 1.00 22.23 H new ATOM 0 HD2 ARG A 134 -2.356 -14.057 -0.003 1.00 24.43 H new ATOM 0 HD3 ARG A 134 -1.101 -14.035 1.220 1.00 24.43 H new ATOM 0 HE ARG A 134 -0.265 -16.141 0.424 1.00 55.21 H new ATOM 0 HH11 ARG A 134 -2.952 -14.968 -1.506 1.00 14.15 H new ATOM 0 HH12 ARG A 134 -2.519 -15.997 -2.875 1.00 14.15 H new ATOM 0 HH21 ARG A 134 0.252 -17.357 -1.285 1.00 51.00 H new ATOM 0 HH22 ARG A 134 -0.736 -17.325 -2.749 1.00 51.00 H new ATOM 2199 N GLY A 135 -5.280 -12.808 4.652 1.00 11.31 N ATOM 2200 CA GLY A 135 -5.612 -11.825 5.681 1.00 25.44 C ATOM 2201 C GLY A 135 -6.266 -12.434 6.930 1.00 61.02 C ATOM 2202 O GLY A 135 -5.898 -12.112 8.057 1.00 44.04 O ATOM 0 H GLY A 135 -5.719 -12.637 3.747 1.00 11.31 H new ATOM 0 HA2 GLY A 135 -4.703 -11.301 5.977 1.00 25.44 H new ATOM 0 HA3 GLY A 135 -6.285 -11.081 5.256 1.00 25.44 H new ATOM 2206 N ILE A 136 -7.219 -13.334 6.703 1.00 42.01 N ATOM 2207 CA ILE A 136 -7.952 -14.043 7.771 1.00 2.45 C ATOM 2208 C ILE A 136 -7.003 -14.893 8.673 1.00 63.15 C ATOM 2209 O ILE A 136 -7.040 -14.773 9.902 1.00 55.45 O ATOM 2210 CB ILE A 136 -9.077 -14.929 7.115 1.00 63.14 C ATOM 2211 CG1 ILE A 136 -10.117 -14.012 6.391 1.00 54.30 C ATOM 2212 CG2 ILE A 136 -9.764 -15.863 8.142 1.00 71.31 C ATOM 2213 CD1 ILE A 136 -11.037 -14.731 5.429 1.00 62.44 C ATOM 0 H ILE A 136 -7.514 -13.601 5.764 1.00 42.01 H new ATOM 0 HA ILE A 136 -8.410 -13.307 8.431 1.00 2.45 H new ATOM 0 HB ILE A 136 -8.606 -15.581 6.379 1.00 63.14 H new ATOM 0 HG12 ILE A 136 -10.724 -13.509 7.144 1.00 54.30 H new ATOM 0 HG13 ILE A 136 -9.579 -13.237 5.846 1.00 54.30 H new ATOM 0 HG21 ILE A 136 -10.532 -16.453 7.641 1.00 71.31 H new ATOM 0 HG22 ILE A 136 -9.022 -16.530 8.580 1.00 71.31 H new ATOM 0 HG23 ILE A 136 -10.223 -15.264 8.929 1.00 71.31 H new ATOM 0 HD11 ILE A 136 -11.722 -14.014 4.976 1.00 62.44 H new ATOM 0 HD12 ILE A 136 -10.445 -15.210 4.649 1.00 62.44 H new ATOM 0 HD13 ILE A 136 -11.608 -15.487 5.968 1.00 62.44 H new ATOM 2225 N GLN A 137 -6.130 -15.708 8.050 1.00 52.04 N ATOM 2226 CA GLN A 137 -5.200 -16.616 8.786 1.00 51.42 C ATOM 2227 C GLN A 137 -4.001 -15.860 9.419 1.00 55.30 C ATOM 2228 O GLN A 137 -3.555 -16.219 10.506 1.00 2.32 O ATOM 2229 CB GLN A 137 -4.697 -17.747 7.855 1.00 71.13 C ATOM 2230 CG GLN A 137 -3.954 -17.251 6.609 1.00 30.13 C ATOM 2231 CD GLN A 137 -3.574 -18.363 5.638 1.00 50.33 C ATOM 2232 OE1 GLN A 137 -2.487 -18.919 5.708 1.00 61.14 O ATOM 2233 NE2 GLN A 137 -4.480 -18.715 4.740 1.00 2.13 N ATOM 0 H GLN A 137 -6.042 -15.763 7.035 1.00 52.04 H new ATOM 0 HA GLN A 137 -5.768 -17.053 9.607 1.00 51.42 H new ATOM 0 HB2 GLN A 137 -4.036 -18.402 8.422 1.00 71.13 H new ATOM 0 HB3 GLN A 137 -5.549 -18.349 7.540 1.00 71.13 H new ATOM 0 HG2 GLN A 137 -4.579 -16.525 6.089 1.00 30.13 H new ATOM 0 HG3 GLN A 137 -3.050 -16.728 6.920 1.00 30.13 H new ATOM 0 HE21 GLN A 137 -5.378 -18.233 4.706 1.00 2.13 H new ATOM 0 HE22 GLN A 137 -4.280 -19.469 4.082 1.00 2.13 H new ATOM 2242 N ASN A 138 -3.514 -14.790 8.747 1.00 22.43 N ATOM 2243 CA ASN A 138 -2.412 -13.931 9.268 1.00 15.44 C ATOM 2244 C ASN A 138 -2.923 -12.982 10.376 1.00 35.51 C ATOM 2245 O ASN A 138 -2.139 -12.212 10.927 1.00 44.45 O ATOM 2246 CB ASN A 138 -1.748 -13.094 8.133 1.00 61.22 C ATOM 2247 CG ASN A 138 -1.097 -13.944 7.039 1.00 72.35 C ATOM 2248 OD1 ASN A 138 -0.657 -15.065 7.272 1.00 34.41 O ATOM 2249 ND2 ASN A 138 -1.028 -13.413 5.835 1.00 23.23 N ATOM 0 H ASN A 138 -3.867 -14.496 7.836 1.00 22.43 H new ATOM 0 HA ASN A 138 -1.662 -14.601 9.688 1.00 15.44 H new ATOM 0 HB2 ASN A 138 -2.502 -12.451 7.680 1.00 61.22 H new ATOM 0 HB3 ASN A 138 -0.993 -12.441 8.570 1.00 61.22 H new ATOM 0 HD21 ASN A 138 -0.601 -13.936 5.071 1.00 23.23 H new ATOM 0 HD22 ASN A 138 -1.401 -12.479 5.667 1.00 23.23 H new ATOM 2256 N GLN A 139 -4.250 -13.035 10.665 1.00 32.34 N ATOM 2257 CA GLN A 139 -4.900 -12.266 11.753 1.00 53.03 C ATOM 2258 C GLN A 139 -4.930 -10.746 11.451 1.00 30.01 C ATOM 2259 O GLN A 139 -4.983 -9.916 12.368 1.00 1.32 O ATOM 2260 CB GLN A 139 -4.240 -12.576 13.135 1.00 10.23 C ATOM 2261 CG GLN A 139 -4.288 -14.064 13.569 1.00 25.22 C ATOM 2262 CD GLN A 139 -5.704 -14.656 13.596 1.00 0.53 C ATOM 2263 OE1 GLN A 139 -6.422 -14.533 14.581 1.00 3.14 O ATOM 2264 NE2 GLN A 139 -6.103 -15.325 12.529 1.00 51.22 N ATOM 0 H GLN A 139 -4.903 -13.619 10.142 1.00 32.34 H new ATOM 0 HA GLN A 139 -5.939 -12.591 11.808 1.00 53.03 H new ATOM 0 HB2 GLN A 139 -3.198 -12.257 13.102 1.00 10.23 H new ATOM 0 HB3 GLN A 139 -4.734 -11.975 13.899 1.00 10.23 H new ATOM 0 HG2 GLN A 139 -3.672 -14.651 12.888 1.00 25.22 H new ATOM 0 HG3 GLN A 139 -3.846 -14.158 14.561 1.00 25.22 H new ATOM 0 HE21 GLN A 139 -5.486 -15.413 11.722 1.00 51.22 H new ATOM 0 HE22 GLN A 139 -7.028 -15.754 12.512 1.00 51.22 H new ATOM 2273 N ALA A 140 -4.943 -10.412 10.147 1.00 35.54 N ATOM 2274 CA ALA A 140 -4.959 -9.024 9.651 1.00 43.35 C ATOM 2275 C ALA A 140 -6.215 -8.241 10.086 1.00 74.11 C ATOM 2276 O ALA A 140 -7.339 -8.582 9.710 1.00 42.14 O ATOM 2277 CB ALA A 140 -4.811 -9.007 8.123 1.00 13.11 C ATOM 0 H ALA A 140 -4.943 -11.107 9.400 1.00 35.54 H new ATOM 0 HA ALA A 140 -4.108 -8.515 10.104 1.00 43.35 H new ATOM 0 HB1 ALA A 140 -4.824 -7.977 7.768 1.00 13.11 H new ATOM 0 HB2 ALA A 140 -3.867 -9.475 7.844 1.00 13.11 H new ATOM 0 HB3 ALA A 140 -5.637 -9.557 7.671 1.00 13.11 H new ATOM 2283 N GLU A 141 -5.992 -7.180 10.878 1.00 33.20 N ATOM 2284 CA GLU A 141 -7.070 -6.342 11.430 1.00 23.31 C ATOM 2285 C GLU A 141 -7.516 -5.246 10.419 1.00 1.14 C ATOM 2286 O GLU A 141 -6.680 -4.705 9.687 1.00 72.51 O ATOM 2287 CB GLU A 141 -6.615 -5.700 12.766 1.00 32.13 C ATOM 2288 CG GLU A 141 -5.391 -4.769 12.663 1.00 34.42 C ATOM 2289 CD GLU A 141 -4.953 -4.219 14.025 1.00 42.43 C ATOM 2290 OE1 GLU A 141 -5.451 -3.152 14.438 1.00 15.35 O ATOM 2291 OE2 GLU A 141 -4.132 -4.874 14.702 1.00 65.25 O ATOM 0 H GLU A 141 -5.058 -6.878 11.154 1.00 33.20 H new ATOM 0 HA GLU A 141 -7.931 -6.982 11.620 1.00 23.31 H new ATOM 0 HB2 GLU A 141 -7.449 -5.133 13.181 1.00 32.13 H new ATOM 0 HB3 GLU A 141 -6.387 -6.496 13.474 1.00 32.13 H new ATOM 0 HG2 GLU A 141 -4.562 -5.314 12.211 1.00 34.42 H new ATOM 0 HG3 GLU A 141 -5.626 -3.938 11.998 1.00 34.42 H new ATOM 2298 N PRO A 142 -8.847 -4.927 10.316 1.00 4.25 N ATOM 2299 CA PRO A 142 -9.952 -5.705 10.954 1.00 74.40 C ATOM 2300 C PRO A 142 -10.249 -7.066 10.242 1.00 5.44 C ATOM 2301 O PRO A 142 -10.561 -7.105 9.043 1.00 1.54 O ATOM 2302 CB PRO A 142 -11.149 -4.731 10.863 1.00 21.43 C ATOM 2303 CG PRO A 142 -10.861 -3.884 9.662 1.00 32.35 C ATOM 2304 CD PRO A 142 -9.359 -3.716 9.622 1.00 13.13 C ATOM 0 HA PRO A 142 -9.709 -6.009 11.972 1.00 74.40 H new ATOM 0 HB2 PRO A 142 -12.090 -5.270 10.751 1.00 21.43 H new ATOM 0 HB3 PRO A 142 -11.235 -4.124 11.764 1.00 21.43 H new ATOM 0 HG2 PRO A 142 -11.225 -4.361 8.752 1.00 32.35 H new ATOM 0 HG3 PRO A 142 -11.360 -2.918 9.737 1.00 32.35 H new ATOM 0 HD2 PRO A 142 -8.990 -3.656 8.598 1.00 13.13 H new ATOM 0 HD3 PRO A 142 -9.045 -2.803 10.128 1.00 13.13 H new ATOM 2312 N ARG A 143 -10.120 -8.172 11.012 1.00 74.32 N ATOM 2313 CA ARG A 143 -10.392 -9.549 10.537 1.00 53.22 C ATOM 2314 C ARG A 143 -11.848 -9.704 10.051 1.00 63.42 C ATOM 2315 O ARG A 143 -12.093 -10.314 9.022 1.00 3.23 O ATOM 2316 CB ARG A 143 -10.141 -10.591 11.663 1.00 30.32 C ATOM 2317 CG ARG A 143 -8.725 -10.588 12.278 1.00 21.12 C ATOM 2318 CD ARG A 143 -8.622 -11.555 13.477 1.00 3.34 C ATOM 2319 NE ARG A 143 -7.335 -11.469 14.182 1.00 75.24 N ATOM 2320 CZ ARG A 143 -7.016 -10.581 15.103 1.00 52.05 C ATOM 2321 NH1 ARG A 143 -7.828 -9.625 15.440 1.00 44.35 N ATOM 2322 NH2 ARG A 143 -5.861 -10.653 15.671 1.00 4.41 N ATOM 0 H ARG A 143 -9.822 -8.133 11.987 1.00 74.32 H new ATOM 0 HA ARG A 143 -9.710 -9.730 9.706 1.00 53.22 H new ATOM 0 HB2 ARG A 143 -10.863 -10.417 12.461 1.00 30.32 H new ATOM 0 HB3 ARG A 143 -10.341 -11.585 11.263 1.00 30.32 H new ATOM 0 HG2 ARG A 143 -7.997 -10.872 11.518 1.00 21.12 H new ATOM 0 HG3 ARG A 143 -8.471 -9.579 12.601 1.00 21.12 H new ATOM 0 HD2 ARG A 143 -9.428 -11.341 14.179 1.00 3.34 H new ATOM 0 HD3 ARG A 143 -8.769 -12.576 13.125 1.00 3.34 H new ATOM 0 HE ARG A 143 -6.625 -12.159 13.937 1.00 75.24 H new ATOM 0 HH11 ARG A 143 -8.739 -9.547 14.989 1.00 44.35 H new ATOM 0 HH12 ARG A 143 -7.554 -8.952 16.156 1.00 44.35 H new ATOM 0 HH21 ARG A 143 -5.208 -11.390 15.406 1.00 4.41 H new ATOM 0 HH22 ARG A 143 -5.601 -9.973 16.385 1.00 4.41 H new ATOM 2336 N GLU A 144 -12.799 -9.134 10.821 1.00 21.11 N ATOM 2337 CA GLU A 144 -14.250 -9.246 10.548 1.00 61.43 C ATOM 2338 C GLU A 144 -14.618 -8.619 9.186 1.00 11.05 C ATOM 2339 O GLU A 144 -15.457 -9.158 8.457 1.00 61.12 O ATOM 2340 CB GLU A 144 -15.067 -8.594 11.700 1.00 41.21 C ATOM 2341 CG GLU A 144 -16.584 -8.867 11.650 1.00 11.42 C ATOM 2342 CD GLU A 144 -17.350 -8.261 12.844 1.00 32.35 C ATOM 2343 OE1 GLU A 144 -17.324 -8.859 13.940 1.00 50.33 O ATOM 2344 OE2 GLU A 144 -17.974 -7.191 12.690 1.00 74.42 O ATOM 0 H GLU A 144 -12.583 -8.582 11.651 1.00 21.11 H new ATOM 0 HA GLU A 144 -14.504 -10.305 10.498 1.00 61.43 H new ATOM 0 HB2 GLU A 144 -14.678 -8.955 12.652 1.00 41.21 H new ATOM 0 HB3 GLU A 144 -14.905 -7.516 11.677 1.00 41.21 H new ATOM 0 HG2 GLU A 144 -16.989 -8.461 10.723 1.00 11.42 H new ATOM 0 HG3 GLU A 144 -16.752 -9.944 11.627 1.00 11.42 H new ATOM 2351 N PHE A 145 -13.950 -7.504 8.840 1.00 5.11 N ATOM 2352 CA PHE A 145 -14.086 -6.875 7.515 1.00 23.31 C ATOM 2353 C PHE A 145 -13.553 -7.812 6.399 1.00 32.40 C ATOM 2354 O PHE A 145 -14.151 -7.913 5.334 1.00 41.25 O ATOM 2355 CB PHE A 145 -13.368 -5.506 7.478 1.00 50.53 C ATOM 2356 CG PHE A 145 -13.579 -4.729 6.179 1.00 22.14 C ATOM 2357 CD1 PHE A 145 -14.866 -4.352 5.779 1.00 61.41 C ATOM 2358 CD2 PHE A 145 -12.508 -4.372 5.362 1.00 51.35 C ATOM 2359 CE1 PHE A 145 -15.071 -3.648 4.607 1.00 22.40 C ATOM 2360 CE2 PHE A 145 -12.715 -3.668 4.190 1.00 1.21 C ATOM 2361 CZ PHE A 145 -13.995 -3.306 3.814 1.00 51.35 C ATOM 0 H PHE A 145 -13.307 -7.018 9.465 1.00 5.11 H new ATOM 0 HA PHE A 145 -15.147 -6.704 7.331 1.00 23.31 H new ATOM 0 HB2 PHE A 145 -13.720 -4.900 8.313 1.00 50.53 H new ATOM 0 HB3 PHE A 145 -12.300 -5.663 7.626 1.00 50.53 H new ATOM 0 HD1 PHE A 145 -15.713 -4.615 6.396 1.00 61.41 H new ATOM 0 HD2 PHE A 145 -11.504 -4.649 5.648 1.00 51.35 H new ATOM 0 HE1 PHE A 145 -16.071 -3.366 4.313 1.00 22.40 H new ATOM 0 HE2 PHE A 145 -11.875 -3.400 3.567 1.00 1.21 H new ATOM 0 HZ PHE A 145 -14.153 -2.755 2.899 1.00 51.35 H new ATOM 2371 N LEU A 146 -12.449 -8.520 6.677 1.00 32.31 N ATOM 2372 CA LEU A 146 -11.862 -9.507 5.737 1.00 33.14 C ATOM 2373 C LEU A 146 -12.772 -10.735 5.534 1.00 75.05 C ATOM 2374 O LEU A 146 -12.856 -11.253 4.426 1.00 50.15 O ATOM 2375 CB LEU A 146 -10.452 -9.946 6.230 1.00 62.33 C ATOM 2376 CG LEU A 146 -9.265 -9.139 5.636 1.00 3.22 C ATOM 2377 CD1 LEU A 146 -7.998 -9.320 6.470 1.00 71.34 C ATOM 2378 CD2 LEU A 146 -9.029 -9.520 4.154 1.00 44.22 C ATOM 0 H LEU A 146 -11.934 -8.431 7.553 1.00 32.31 H new ATOM 0 HA LEU A 146 -11.767 -9.017 4.768 1.00 33.14 H new ATOM 0 HB2 LEU A 146 -10.421 -9.861 7.316 1.00 62.33 H new ATOM 0 HB3 LEU A 146 -10.312 -11.000 5.989 1.00 62.33 H new ATOM 0 HG LEU A 146 -9.525 -8.081 5.671 1.00 3.22 H new ATOM 0 HD11 LEU A 146 -7.186 -8.743 6.028 1.00 71.34 H new ATOM 0 HD12 LEU A 146 -8.179 -8.972 7.487 1.00 71.34 H new ATOM 0 HD13 LEU A 146 -7.724 -10.375 6.491 1.00 71.34 H new ATOM 0 HD21 LEU A 146 -8.193 -8.943 3.759 1.00 44.22 H new ATOM 0 HD22 LEU A 146 -8.801 -10.584 4.084 1.00 44.22 H new ATOM 0 HD23 LEU A 146 -9.926 -9.302 3.575 1.00 44.22 H new ATOM 2390 N GLN A 147 -13.437 -11.196 6.607 1.00 23.41 N ATOM 2391 CA GLN A 147 -14.307 -12.388 6.564 1.00 71.32 C ATOM 2392 C GLN A 147 -15.645 -12.094 5.839 1.00 13.23 C ATOM 2393 O GLN A 147 -16.144 -12.944 5.088 1.00 13.55 O ATOM 2394 CB GLN A 147 -14.549 -12.931 7.999 1.00 11.41 C ATOM 2395 CG GLN A 147 -13.248 -13.257 8.769 1.00 33.42 C ATOM 2396 CD GLN A 147 -13.464 -14.063 10.052 1.00 40.43 C ATOM 2397 OE1 GLN A 147 -13.678 -13.511 11.126 1.00 35.34 O ATOM 2398 NE2 GLN A 147 -13.402 -15.378 9.947 1.00 0.04 N ATOM 0 H GLN A 147 -13.388 -10.756 7.526 1.00 23.41 H new ATOM 0 HA GLN A 147 -13.796 -13.158 5.987 1.00 71.32 H new ATOM 0 HB2 GLN A 147 -15.121 -12.195 8.565 1.00 11.41 H new ATOM 0 HB3 GLN A 147 -15.160 -13.832 7.939 1.00 11.41 H new ATOM 0 HG2 GLN A 147 -12.580 -13.813 8.112 1.00 33.42 H new ATOM 0 HG3 GLN A 147 -12.744 -12.324 9.020 1.00 33.42 H new ATOM 0 HE21 GLN A 147 -13.222 -15.809 9.040 1.00 0.04 H new ATOM 0 HE22 GLN A 147 -13.534 -15.962 10.773 1.00 0.04 H new ATOM 2407 N GLN A 148 -16.215 -10.884 6.060 1.00 72.24 N ATOM 2408 CA GLN A 148 -17.425 -10.439 5.330 1.00 34.25 C ATOM 2409 C GLN A 148 -17.110 -10.213 3.834 1.00 1.15 C ATOM 2410 O GLN A 148 -17.872 -10.637 2.975 1.00 64.31 O ATOM 2411 CB GLN A 148 -18.074 -9.169 5.963 1.00 34.24 C ATOM 2412 CG GLN A 148 -17.247 -7.882 5.865 1.00 13.13 C ATOM 2413 CD GLN A 148 -17.899 -6.674 6.535 1.00 54.42 C ATOM 2414 OE1 GLN A 148 -17.730 -6.438 7.723 1.00 14.13 O ATOM 2415 NE2 GLN A 148 -18.634 -5.888 5.772 1.00 40.54 N ATOM 0 H GLN A 148 -15.859 -10.205 6.732 1.00 72.24 H new ATOM 0 HA GLN A 148 -18.159 -11.240 5.415 1.00 34.25 H new ATOM 0 HB2 GLN A 148 -19.037 -8.998 5.483 1.00 34.24 H new ATOM 0 HB3 GLN A 148 -18.274 -9.372 7.015 1.00 34.24 H new ATOM 0 HG2 GLN A 148 -16.271 -8.054 6.319 1.00 13.13 H new ATOM 0 HG3 GLN A 148 -17.074 -7.652 4.814 1.00 13.13 H new ATOM 0 HE21 GLN A 148 -18.759 -6.108 4.784 1.00 40.54 H new ATOM 0 HE22 GLN A 148 -19.078 -5.060 6.170 1.00 40.54 H new ATOM 2424 N GLN A 149 -15.955 -9.580 3.526 1.00 21.30 N ATOM 2425 CA GLN A 149 -15.528 -9.360 2.128 1.00 10.11 C ATOM 2426 C GLN A 149 -15.126 -10.677 1.444 1.00 32.42 C ATOM 2427 O GLN A 149 -15.285 -10.799 0.243 1.00 43.11 O ATOM 2428 CB GLN A 149 -14.377 -8.327 2.040 1.00 5.21 C ATOM 2429 CG GLN A 149 -14.770 -6.897 2.466 1.00 22.41 C ATOM 2430 CD GLN A 149 -15.925 -6.311 1.655 1.00 25.25 C ATOM 2431 OE1 GLN A 149 -15.725 -5.671 0.633 1.00 72.14 O ATOM 2432 NE2 GLN A 149 -17.146 -6.533 2.103 1.00 51.01 N ATOM 0 H GLN A 149 -15.306 -9.215 4.223 1.00 21.30 H new ATOM 0 HA GLN A 149 -16.387 -8.953 1.595 1.00 10.11 H new ATOM 0 HB2 GLN A 149 -13.552 -8.666 2.667 1.00 5.21 H new ATOM 0 HB3 GLN A 149 -14.008 -8.299 1.015 1.00 5.21 H new ATOM 0 HG2 GLN A 149 -15.045 -6.904 3.521 1.00 22.41 H new ATOM 0 HG3 GLN A 149 -13.901 -6.246 2.367 1.00 22.41 H new ATOM 0 HE21 GLN A 149 -17.285 -7.070 2.959 1.00 51.01 H new ATOM 0 HE22 GLN A 149 -17.950 -6.167 1.594 1.00 51.01 H new ATOM 2441 N TYR A 150 -14.613 -11.649 2.223 1.00 54.24 N ATOM 2442 CA TYR A 150 -14.292 -13.001 1.716 1.00 41.44 C ATOM 2443 C TYR A 150 -15.575 -13.713 1.242 1.00 33.24 C ATOM 2444 O TYR A 150 -15.666 -14.080 0.083 1.00 30.10 O ATOM 2445 CB TYR A 150 -13.565 -13.851 2.796 1.00 33.10 C ATOM 2446 CG TYR A 150 -13.063 -15.241 2.330 1.00 52.33 C ATOM 2447 CD1 TYR A 150 -11.803 -15.393 1.747 1.00 73.31 C ATOM 2448 CD2 TYR A 150 -13.840 -16.391 2.488 1.00 64.04 C ATOM 2449 CE1 TYR A 150 -11.340 -16.628 1.335 1.00 63.13 C ATOM 2450 CE2 TYR A 150 -13.381 -17.630 2.077 1.00 62.25 C ATOM 2451 CZ TYR A 150 -12.131 -17.743 1.501 1.00 61.31 C ATOM 2452 OH TYR A 150 -11.673 -18.976 1.094 1.00 2.12 O ATOM 0 H TYR A 150 -14.410 -11.523 3.215 1.00 54.24 H new ATOM 0 HA TYR A 150 -13.616 -12.891 0.868 1.00 41.44 H new ATOM 0 HB2 TYR A 150 -12.712 -13.282 3.166 1.00 33.10 H new ATOM 0 HB3 TYR A 150 -14.243 -13.993 3.638 1.00 33.10 H new ATOM 0 HD1 TYR A 150 -11.175 -14.524 1.615 1.00 73.31 H new ATOM 0 HD2 TYR A 150 -14.818 -16.312 2.940 1.00 64.04 H new ATOM 0 HE1 TYR A 150 -10.362 -16.718 0.885 1.00 63.13 H new ATOM 0 HE2 TYR A 150 -13.999 -18.506 2.206 1.00 62.25 H new ATOM 0 HH TYR A 150 -12.352 -19.656 1.284 1.00 2.12 H new ATOM 2462 N ARG A 151 -16.571 -13.856 2.144 1.00 12.22 N ATOM 2463 CA ARG A 151 -17.827 -14.604 1.853 1.00 64.14 C ATOM 2464 C ARG A 151 -18.679 -13.919 0.747 1.00 53.44 C ATOM 2465 O ARG A 151 -19.275 -14.598 -0.100 1.00 21.35 O ATOM 2466 CB ARG A 151 -18.654 -14.809 3.153 1.00 51.23 C ATOM 2467 CG ARG A 151 -19.212 -13.527 3.802 1.00 45.32 C ATOM 2468 CD ARG A 151 -19.765 -13.763 5.220 1.00 40.41 C ATOM 2469 NE ARG A 151 -20.816 -14.799 5.257 1.00 4.54 N ATOM 2470 CZ ARG A 151 -20.991 -15.690 6.217 1.00 20.21 C ATOM 2471 NH1 ARG A 151 -20.204 -15.735 7.257 1.00 20.22 N ATOM 2472 NH2 ARG A 151 -21.966 -16.540 6.134 1.00 55.25 N ATOM 0 H ARG A 151 -16.534 -13.464 3.085 1.00 12.22 H new ATOM 0 HA ARG A 151 -17.541 -15.582 1.466 1.00 64.14 H new ATOM 0 HB2 ARG A 151 -19.489 -15.473 2.929 1.00 51.23 H new ATOM 0 HB3 ARG A 151 -18.027 -15.320 3.883 1.00 51.23 H new ATOM 0 HG2 ARG A 151 -18.424 -12.776 3.846 1.00 45.32 H new ATOM 0 HG3 ARG A 151 -20.004 -13.122 3.172 1.00 45.32 H new ATOM 0 HD2 ARG A 151 -18.948 -14.056 5.880 1.00 40.41 H new ATOM 0 HD3 ARG A 151 -20.169 -12.828 5.608 1.00 40.41 H new ATOM 0 HE ARG A 151 -21.465 -14.830 4.471 1.00 4.54 H new ATOM 0 HH11 ARG A 151 -19.433 -15.073 7.342 1.00 20.22 H new ATOM 0 HH12 ARG A 151 -20.360 -16.432 7.985 1.00 20.22 H new ATOM 0 HH21 ARG A 151 -22.594 -16.519 5.330 1.00 55.25 H new ATOM 0 HH22 ARG A 151 -22.105 -17.230 6.872 1.00 55.25 H new ATOM 2486 N LEU A 152 -18.689 -12.569 0.733 1.00 22.42 N ATOM 2487 CA LEU A 152 -19.389 -11.782 -0.306 1.00 61.13 C ATOM 2488 C LEU A 152 -18.652 -11.892 -1.659 1.00 53.11 C ATOM 2489 O LEU A 152 -19.275 -11.852 -2.711 1.00 24.51 O ATOM 2490 CB LEU A 152 -19.535 -10.301 0.140 1.00 52.31 C ATOM 2491 CG LEU A 152 -20.506 -10.057 1.344 1.00 51.33 C ATOM 2492 CD1 LEU A 152 -20.429 -8.599 1.855 1.00 23.35 C ATOM 2493 CD2 LEU A 152 -21.960 -10.456 0.985 1.00 72.24 C ATOM 0 H LEU A 152 -18.217 -11.998 1.434 1.00 22.42 H new ATOM 0 HA LEU A 152 -20.390 -12.191 -0.439 1.00 61.13 H new ATOM 0 HB2 LEU A 152 -18.549 -9.920 0.407 1.00 52.31 H new ATOM 0 HB3 LEU A 152 -19.883 -9.715 -0.711 1.00 52.31 H new ATOM 0 HG LEU A 152 -20.179 -10.702 2.160 1.00 51.33 H new ATOM 0 HD11 LEU A 152 -21.117 -8.469 2.690 1.00 23.35 H new ATOM 0 HD12 LEU A 152 -19.413 -8.382 2.185 1.00 23.35 H new ATOM 0 HD13 LEU A 152 -20.703 -7.917 1.050 1.00 23.35 H new ATOM 0 HD21 LEU A 152 -22.609 -10.275 1.842 1.00 72.24 H new ATOM 0 HD22 LEU A 152 -22.302 -9.861 0.138 1.00 72.24 H new ATOM 0 HD23 LEU A 152 -21.993 -11.513 0.722 1.00 72.24 H new ATOM 2505 N PHE A 153 -17.320 -12.014 -1.606 1.00 33.20 N ATOM 2506 CA PHE A 153 -16.493 -12.348 -2.783 1.00 42.34 C ATOM 2507 C PHE A 153 -16.788 -13.783 -3.314 1.00 22.12 C ATOM 2508 O PHE A 153 -16.827 -14.002 -4.528 1.00 14.02 O ATOM 2509 CB PHE A 153 -15.000 -12.205 -2.403 1.00 41.32 C ATOM 2510 CG PHE A 153 -14.070 -12.066 -3.580 1.00 11.03 C ATOM 2511 CD1 PHE A 153 -13.540 -13.186 -4.210 1.00 74.01 C ATOM 2512 CD2 PHE A 153 -13.736 -10.804 -4.070 1.00 60.51 C ATOM 2513 CE1 PHE A 153 -12.711 -13.049 -5.284 1.00 73.14 C ATOM 2514 CE2 PHE A 153 -12.900 -10.673 -5.149 1.00 72.44 C ATOM 2515 CZ PHE A 153 -12.393 -11.795 -5.755 1.00 51.22 C ATOM 0 H PHE A 153 -16.781 -11.885 -0.750 1.00 33.20 H new ATOM 0 HA PHE A 153 -16.740 -11.657 -3.589 1.00 42.34 H new ATOM 0 HB2 PHE A 153 -14.883 -11.334 -1.758 1.00 41.32 H new ATOM 0 HB3 PHE A 153 -14.701 -13.076 -1.820 1.00 41.32 H new ATOM 0 HD1 PHE A 153 -13.787 -14.172 -3.846 1.00 74.01 H new ATOM 0 HD2 PHE A 153 -14.139 -9.922 -3.595 1.00 60.51 H new ATOM 0 HE1 PHE A 153 -12.303 -13.925 -5.766 1.00 73.14 H new ATOM 0 HE2 PHE A 153 -12.642 -9.692 -5.520 1.00 72.44 H new ATOM 0 HZ PHE A 153 -11.739 -11.693 -6.609 1.00 51.22 H new ATOM 2525 N GLN A 154 -17.009 -14.750 -2.388 1.00 63.24 N ATOM 2526 CA GLN A 154 -17.273 -16.170 -2.750 1.00 75.02 C ATOM 2527 C GLN A 154 -18.635 -16.320 -3.444 1.00 4.00 C ATOM 2528 O GLN A 154 -18.765 -17.063 -4.429 1.00 64.40 O ATOM 2529 CB GLN A 154 -17.207 -17.117 -1.517 1.00 45.40 C ATOM 2530 CG GLN A 154 -15.906 -17.030 -0.698 1.00 11.41 C ATOM 2531 CD GLN A 154 -14.619 -17.119 -1.527 1.00 75.30 C ATOM 2532 OE1 GLN A 154 -14.522 -17.854 -2.509 1.00 3.31 O ATOM 2533 NE2 GLN A 154 -13.644 -16.314 -1.168 1.00 50.22 N ATOM 0 H GLN A 154 -17.010 -14.574 -1.383 1.00 63.24 H new ATOM 0 HA GLN A 154 -16.483 -16.463 -3.441 1.00 75.02 H new ATOM 0 HB2 GLN A 154 -18.048 -16.893 -0.860 1.00 45.40 H new ATOM 0 HB3 GLN A 154 -17.335 -18.144 -1.859 1.00 45.40 H new ATOM 0 HG2 GLN A 154 -15.902 -16.090 -0.146 1.00 11.41 H new ATOM 0 HG3 GLN A 154 -15.903 -17.832 0.040 1.00 11.41 H new ATOM 0 HE21 GLN A 154 -13.752 -15.716 -0.349 1.00 50.22 H new ATOM 0 HE22 GLN A 154 -12.779 -16.288 -1.708 1.00 50.22 H new ATOM 2542 N THR A 155 -19.639 -15.567 -2.953 1.00 71.22 N ATOM 2543 CA THR A 155 -20.992 -15.603 -3.540 1.00 41.43 C ATOM 2544 C THR A 155 -20.996 -14.976 -4.956 1.00 52.55 C ATOM 2545 O THR A 155 -21.858 -15.293 -5.771 1.00 10.23 O ATOM 2546 CB THR A 155 -22.089 -14.941 -2.633 1.00 22.23 C ATOM 2547 OG1 THR A 155 -23.401 -15.251 -3.137 1.00 3.24 O ATOM 2548 CG2 THR A 155 -21.954 -13.422 -2.521 1.00 12.14 C ATOM 0 H THR A 155 -19.540 -14.933 -2.160 1.00 71.22 H new ATOM 0 HA THR A 155 -21.259 -16.657 -3.616 1.00 41.43 H new ATOM 0 HB THR A 155 -21.944 -15.357 -1.636 1.00 22.23 H new ATOM 0 HG1 THR A 155 -23.514 -14.851 -4.024 1.00 3.24 H new ATOM 0 HG21 THR A 155 -22.745 -13.033 -1.880 1.00 12.14 H new ATOM 0 HG22 THR A 155 -20.983 -13.174 -2.092 1.00 12.14 H new ATOM 0 HG23 THR A 155 -22.038 -12.975 -3.512 1.00 12.14 H new ATOM 2556 N ARG A 156 -20.005 -14.097 -5.250 1.00 2.21 N ATOM 2557 CA ARG A 156 -19.798 -13.554 -6.605 1.00 11.31 C ATOM 2558 C ARG A 156 -19.271 -14.638 -7.570 1.00 11.31 C ATOM 2559 O ARG A 156 -19.924 -14.954 -8.552 1.00 12.04 O ATOM 2560 CB ARG A 156 -18.802 -12.366 -6.574 1.00 3.12 C ATOM 2561 CG ARG A 156 -19.266 -11.150 -5.753 1.00 2.23 C ATOM 2562 CD ARG A 156 -18.178 -10.074 -5.651 1.00 54.13 C ATOM 2563 NE ARG A 156 -18.516 -9.011 -4.693 1.00 33.43 N ATOM 2564 CZ ARG A 156 -17.721 -8.007 -4.371 1.00 73.43 C ATOM 2565 NH1 ARG A 156 -16.551 -7.865 -4.923 1.00 53.12 N ATOM 2566 NH2 ARG A 156 -18.097 -7.136 -3.500 1.00 74.24 N ATOM 0 H ARG A 156 -19.338 -13.752 -4.560 1.00 2.21 H new ATOM 0 HA ARG A 156 -20.766 -13.205 -6.965 1.00 11.31 H new ATOM 0 HB2 ARG A 156 -17.853 -12.718 -6.170 1.00 3.12 H new ATOM 0 HB3 ARG A 156 -18.613 -12.043 -7.598 1.00 3.12 H new ATOM 0 HG2 ARG A 156 -20.157 -10.722 -6.212 1.00 2.23 H new ATOM 0 HG3 ARG A 156 -19.548 -11.475 -4.752 1.00 2.23 H new ATOM 0 HD2 ARG A 156 -17.239 -10.540 -5.353 1.00 54.13 H new ATOM 0 HD3 ARG A 156 -18.017 -9.633 -6.634 1.00 54.13 H new ATOM 0 HE ARG A 156 -19.431 -9.052 -4.245 1.00 33.43 H new ATOM 0 HH11 ARG A 156 -16.231 -8.537 -5.620 1.00 53.12 H new ATOM 0 HH12 ARG A 156 -15.954 -7.081 -4.658 1.00 53.12 H new ATOM 0 HH21 ARG A 156 -19.012 -7.220 -3.056 1.00 74.24 H new ATOM 0 HH22 ARG A 156 -17.480 -6.362 -3.254 1.00 74.24 H new ATOM 2580 N LEU A 157 -18.089 -15.212 -7.251 1.00 5.32 N ATOM 2581 CA LEU A 157 -17.384 -16.171 -8.144 1.00 72.45 C ATOM 2582 C LEU A 157 -18.169 -17.490 -8.377 1.00 13.33 C ATOM 2583 O LEU A 157 -17.998 -18.137 -9.414 1.00 53.20 O ATOM 2584 CB LEU A 157 -15.925 -16.431 -7.637 1.00 53.31 C ATOM 2585 CG LEU A 157 -15.726 -16.859 -6.136 1.00 64.31 C ATOM 2586 CD1 LEU A 157 -16.077 -18.343 -5.882 1.00 20.33 C ATOM 2587 CD2 LEU A 157 -14.297 -16.529 -5.641 1.00 43.14 C ATOM 0 H LEU A 157 -17.597 -15.029 -6.376 1.00 5.32 H new ATOM 0 HA LEU A 157 -17.323 -15.700 -9.125 1.00 72.45 H new ATOM 0 HB2 LEU A 157 -15.487 -17.207 -8.265 1.00 53.31 H new ATOM 0 HB3 LEU A 157 -15.347 -15.522 -7.804 1.00 53.31 H new ATOM 0 HG LEU A 157 -16.433 -16.270 -5.553 1.00 64.31 H new ATOM 0 HD11 LEU A 157 -15.920 -18.579 -4.830 1.00 20.33 H new ATOM 0 HD12 LEU A 157 -17.121 -18.520 -6.142 1.00 20.33 H new ATOM 0 HD13 LEU A 157 -15.438 -18.978 -6.495 1.00 20.33 H new ATOM 0 HD21 LEU A 157 -14.192 -16.837 -4.601 1.00 43.14 H new ATOM 0 HD22 LEU A 157 -13.568 -17.061 -6.252 1.00 43.14 H new ATOM 0 HD23 LEU A 157 -14.123 -15.456 -5.721 1.00 43.14 H new ATOM 2599 N THR A 158 -19.013 -17.894 -7.404 1.00 2.14 N ATOM 2600 CA THR A 158 -19.880 -19.094 -7.562 1.00 43.40 C ATOM 2601 C THR A 158 -21.098 -18.828 -8.497 1.00 44.35 C ATOM 2602 O THR A 158 -21.616 -19.756 -9.130 1.00 61.34 O ATOM 2603 CB THR A 158 -20.362 -19.657 -6.178 1.00 4.31 C ATOM 2604 OG1 THR A 158 -20.937 -20.967 -6.346 1.00 24.33 O ATOM 2605 CG2 THR A 158 -21.389 -18.745 -5.481 1.00 73.31 C ATOM 0 H THR A 158 -19.116 -17.417 -6.508 1.00 2.14 H new ATOM 0 HA THR A 158 -19.259 -19.853 -8.038 1.00 43.40 H new ATOM 0 HB THR A 158 -19.478 -19.705 -5.542 1.00 4.31 H new ATOM 0 HG1 THR A 158 -21.233 -21.309 -5.476 1.00 24.33 H new ATOM 0 HG21 THR A 158 -21.683 -19.189 -4.530 1.00 73.31 H new ATOM 0 HG22 THR A 158 -20.944 -17.766 -5.303 1.00 73.31 H new ATOM 0 HG23 THR A 158 -22.268 -18.634 -6.117 1.00 73.31 H new ATOM 2613 N GLU A 159 -21.548 -17.557 -8.574 1.00 52.22 N ATOM 2614 CA GLU A 159 -22.658 -17.135 -9.480 1.00 61.23 C ATOM 2615 C GLU A 159 -22.136 -16.705 -10.879 1.00 12.14 C ATOM 2616 O GLU A 159 -22.806 -16.914 -11.897 1.00 2.20 O ATOM 2617 CB GLU A 159 -23.475 -15.976 -8.832 1.00 3.44 C ATOM 2618 CG GLU A 159 -24.304 -16.395 -7.596 1.00 62.21 C ATOM 2619 CD GLU A 159 -25.127 -15.241 -6.983 1.00 42.41 C ATOM 2620 OE1 GLU A 159 -26.042 -14.719 -7.668 1.00 75.01 O ATOM 2621 OE2 GLU A 159 -24.865 -14.845 -5.824 1.00 13.13 O ATOM 0 H GLU A 159 -21.161 -16.794 -8.018 1.00 52.22 H new ATOM 0 HA GLU A 159 -23.308 -17.998 -9.623 1.00 61.23 H new ATOM 0 HB2 GLU A 159 -22.788 -15.181 -8.542 1.00 3.44 H new ATOM 0 HB3 GLU A 159 -24.147 -15.558 -9.581 1.00 3.44 H new ATOM 0 HG2 GLU A 159 -24.980 -17.202 -7.879 1.00 62.21 H new ATOM 0 HG3 GLU A 159 -23.632 -16.794 -6.836 1.00 62.21 H new ATOM 2628 N THR A 160 -20.933 -16.110 -10.910 1.00 71.52 N ATOM 2629 CA THR A 160 -20.316 -15.539 -12.138 1.00 44.04 C ATOM 2630 C THR A 160 -18.943 -16.218 -12.410 1.00 53.12 C ATOM 2631 O THR A 160 -17.998 -16.005 -11.620 1.00 21.13 O ATOM 2632 CB THR A 160 -20.151 -13.968 -12.046 1.00 33.32 C ATOM 2633 OG1 THR A 160 -19.332 -13.597 -10.919 1.00 72.33 O ATOM 2634 CG2 THR A 160 -21.511 -13.251 -11.930 1.00 75.12 C ATOM 2635 OXT THR A 160 -18.815 -16.966 -13.407 1.00 37.36 O ATOM 0 H THR A 160 -20.349 -16.006 -10.081 1.00 71.52 H new ATOM 0 HA THR A 160 -20.989 -15.742 -12.971 1.00 44.04 H new ATOM 0 HB THR A 160 -19.667 -13.655 -12.971 1.00 33.32 H new ATOM 0 HG1 THR A 160 -19.604 -14.115 -10.133 1.00 72.33 H new ATOM 0 HG21 THR A 160 -21.351 -12.175 -11.869 1.00 75.12 H new ATOM 0 HG22 THR A 160 -22.118 -13.479 -12.806 1.00 75.12 H new ATOM 0 HG23 THR A 160 -22.027 -13.592 -11.032 1.00 75.12 H new TER 2643 THR A 160